# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-20T19:11:24+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 'Organic & Biomolecular Chemistry') AND volume = 6 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
"7150796","5.07959","0.00013","16.8946","0.0004","27.9131","0.0007","78.308","0.0014","89.999","0.0014","81.384","0.0014","2318.12","0.1","296.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C25 H28 N2 O6 -","- C25 H28 N2 O6 -","- C100 H112 N8 O24 -","4","2","","Ando, Kumiko; Kawamura, Yoko; Akai, Yukiko; Kunitomo, Jun-ichi; Yokomizo, Takehiko; Yamashita, Masayuki; Ohta, Shunsaku; Ohishi, Takahiro; Ohishi, Yoshitaka","Preparation of 2-, 3-, 4- and 7-(2-alkylcarbamoyl-1-alkylvinyl)benzo[b]furans and their BLT1 and/or BLT2 inhibitory activities","Organic & Biomolecular Chemistry","2008","6","2","296","307","10.1039/b710935k","","","1.54187","CuKα","","","0.0355","","","","0.0986","","","","","","1.008","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150797","33.4101","0.0008","5.07911","0.00013","27.9188","0.0007","90","","101.832","0.0014","90","","4637","0.2","296.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H28 N2 O6 -","- C25 H28 N2 O6 -","- C200 H224 N16 O48 -","8","1","","Ando, Kumiko; Kawamura, Yoko; Akai, Yukiko; Kunitomo, Jun-ichi; Yokomizo, Takehiko; Yamashita, Masayuki; Ohta, Shunsaku; Ohishi, Takahiro; Ohishi, Yoshitaka","Preparation of 2-, 3-, 4- and 7-(2-alkylcarbamoyl-1-alkylvinyl)benzo[b]furans and their BLT1 and/or BLT2 inhibitory activities","Organic & Biomolecular Chemistry","2008","6","2","296","307","10.1039/b710935k","","","1.54187","CuKα","","","0.0448","","","","0.17","","","","","","1.004","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150798","10.2817","0.0001","10.6027","0.0001","11.7395","0.0002","64.164","0.001","86.195","0.001","73.578","0.001","1102.46","0.03","","","293","2","","","","","","","Homologous Wittig-type reaction of alpha-phosphonoalkanoate anion with epoxide","4","P -1","-P 1","2","","Dicyclohexylammoinum (1S*,2R*)-1-Benzyl-2-methyl- cyclopropanecarboxylate","","- C24 H37 N O2 -","- C24 H37 N O2 -","- C48 H74 N2 O4 -","2","1","","Krawczyk, Henryk; Wąsek, Katarzyna; Kędzia, Jacek; Wojciechowski, Jakub; Wolf, Wojciech M.","A general stereoselective method for the synthesis of cyclopropanecarboxylates. A new version of the homologous Horner‒Wadsworth‒Emmons reaction","Organic & Biomolecular Chemistry","2008","6","2","308","318","10.1039/b712145h","","","","","","0.0499","0.048","","","0.1374","0.1401","","","","","","1.052","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150799","8.068","0.0002","10.874","0.0002","19.198","0.0005","105.27","0.001","98.082","0.001","98.075","0.001","1580.65","0.06","150","2","150","2","","","","","","","Synthesized","4","P -1","-P 1","2","Nitro-Bn-iPr-nPr-Ester","","","- C35 H35 N3 O9 -","- C35 H35 N3 O9 -","- C70 H70 N6 O18 -","2","1","","Plante, Jeffrey; Campbell, Fred; Malkova, Barbora; Kilner, Colin; Warriner, Stuart L.; Wilson, Andrew J.","Synthesis of functionalised aromatic oligamide rods","Organic & Biomolecular Chemistry","2008","6","1","138","146","10.1039/b712606a","","x-ray","0.71073","MoKα","","0.0866","0.049","","","0.125","0.1638","","","","","","1.062","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150800","11.961","0.005","19.647","0.005","9.048","0.005","90","","94.251","0.005","90","","2120.4","1.6","153","2","153","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C23 H25 N3 O3 -","- C23 H25 N3 O3 -","- C92 H100 N12 O12 -","4","1","","Korotkikh, Nikolai I.; Cowley, Alan H.; Moore, Jennifer A.; Glinyanaya, Nataliya V.; Panov, Ilia S.; Rayenko, Gennady F.; Pekhtereva, Tatyana M.; Shvaika, Oles P.","Reaction of 1-tert-butyl-3,4-diphenyl-1,2,4-triazol-5-ylidenes with a malonic ester","Organic & Biomolecular Chemistry","2008","6","1","195","199","10.1039/b712885a","","","0.71073","MoKα","","0.2404","0.0646","","","0.1139","0.1718","","","","","","0.967","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150801","17.3668","0.0007","11.4423","0.0003","23.2936","0.0009","90","","108.973","0.0017","90","","4377.3","0.3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C54 H56 O6 -","- C54 H56 O6 -","- C216 H224 O24 -","4","1","","Barton, Olaf G.; Neumann, B.; Stammler, H.-G.; Mattay, Jochen","Intramolecular direct arylation in an A,C-functionalized calix[4]arene","Organic & Biomolecular Chemistry","2008","6","1","104","111","10.1039/b713357j","","","0.71073","MoKα","","0.0971","0.0563","","","0.1232","0.1447","","","","","","1.01","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150802","11.5936","0.0002","11.6506","0.0003","17.2247","0.0003","73.0552","0.0011","75.3562","0.0013","77.6072","0.0012","2128.17","0.08","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C54 H56 O6 -","- C54 H56 O6 -","- C108 H112 O12 -","2","1","","Barton, Olaf G.; Neumann, B.; Stammler, H.-G.; Mattay, Jochen","Intramolecular direct arylation in an A,C-functionalized calix[4]arene","Organic & Biomolecular Chemistry","2008","6","1","104","111","10.1039/b713357j","","","0.71073","MoKα","","0.1005","0.0526","","","0.1122","0.1271","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150803","8.7674","0.0009","9.3303","0.0009","31.529","0.003","90","","90","","90","","2579.2","0.4","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Dicobalt hexacarbonyl 5-((1-hydroxycyclohexyl)ethynyl)-2'- deoxyuridine","Dicobalt hexacarbonyl 5-[(1-hydroxycyclohexyl)ethynyl]-2'-deoxyuridine","","- C23 H22 Co2 N2 O12 -","- C23 H22 Co2 N2 O12 -","- C92 H88 Co8 N8 O48 -","4","1","","Sergeant, Craig D.; Ott, Ingo; Sniady, Adam; Meneni, Srinivasarao; Gust, Ronald; Rheingold, Arnold L.; Dembinski, Roman","Metallo-nucleosides: synthesis and biological evaluation of hexacarbonyl dicobalt 5-alkynyl-2′-deoxyuridines","Organic & Biomolecular Chemistry","2008","6","1","73","80","10.1039/b713371e","","","0.71073","MoKα","","0.0431","0.0362","","","0.076","0.0786","","","","","","1.026","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150804","9.5122","0.0005","13.5695","0.0007","9.9716","0.0005","90","","106.4","0.002","90","","1234.73","0.11","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H15 N3 -","- C15 H15 N3 -","- C60 H60 N12 -","4","1","","Johnston, Karen A.; Allcock, Robert W.; Jiang, Zhong; Collier, Ian D.; Blakli, Haakon; Rosair, Georgina M.; Bailey, Patrick D.; Morgan, Keith M.; Kohno, Yasushi; Adams, David R.","Concise routes to pyrazolo[1,5-a]pyridin-3-yl pyridazin-3-ones","Organic & Biomolecular Chemistry","2008","6","1","175","186","10.1039/b713638b","","","0.71073","MoKα","","0.0454","0.0382","","","0.1076","0.1132","","","","","","1.065","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150805","8.176","0.0005","23.3585","0.0015","9.0849","0.0005","90","","95.397","0.002","90","","1727.33","0.18","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 N4 O -","- C21 H22 N4 O -","- C84 H88 N16 O4 -","4","1","","Johnston, Karen A.; Allcock, Robert W.; Jiang, Zhong; Collier, Ian D.; Blakli, Haakon; Rosair, Georgina M.; Bailey, Patrick D.; Morgan, Keith M.; Kohno, Yasushi; Adams, David R.","Concise routes to pyrazolo[1,5-a]pyridin-3-yl pyridazin-3-ones","Organic & Biomolecular Chemistry","2008","6","1","175","186","10.1039/b713638b","","","0.71073","MoKα","","0.0519","0.0425","","","0.11","0.1163","","","","","","1.012","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150806","8.9123","0.0006","10.1067","0.0007","19.3558","0.0014","90","","90.98","0.002","90","","1743.2","0.2","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 N4 O -","- C21 H20 N4 O -","- C84 H80 N16 O4 -","4","1","","Johnston, Karen A.; Allcock, Robert W.; Jiang, Zhong; Collier, Ian D.; Blakli, Haakon; Rosair, Georgina M.; Bailey, Patrick D.; Morgan, Keith M.; Kohno, Yasushi; Adams, David R.","Concise routes to pyrazolo[1,5-a]pyridin-3-yl pyridazin-3-ones","Organic & Biomolecular Chemistry","2008","6","1","175","186","10.1039/b713638b","","","0.71073","MoKα","","0.0751","0.0415","","","0.0823","0.1009","","","","","","0.993","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150807","5.2709","0.0012","16.736","0.004","12.148","0.003","90","","97.432","0.004","90","","1062.6","0.4","180","2","180","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C16 H28 N4 O9 S -","- C16 H28 N4 O9 S -","- C32 H56 N8 O18 S2 -","2","1","","Christensen, Mikkel S.; Bond, Andrew D.; Nielsen, Poul","Synthetic nucleic acid secondary structures containing the four stereoisomers of 1,4-bis(thymine-1-yl)butane-2,3-diol","Organic & Biomolecular Chemistry","2008","6","1","81","91","10.1039/b713888a","","","0.71073","MoKα","","0.0564","0.0488","","","0.132","0.138","","","","","","1.065","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150808","5.224","0.002","9.313","0.004","12.558","0.006","101.76","0.03","91.68","0.03","105","0.03","575.6","0.4","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H30 N4 O8 S2 -","- C18 H30 N4 O8 S2 -","- C18 H30 N4 O8 S2 -","1","0.5","","Christensen, Mikkel S.; Bond, Andrew D.; Nielsen, Poul","Synthetic nucleic acid secondary structures containing the four stereoisomers of 1,4-bis(thymine-1-yl)butane-2,3-diol","Organic & Biomolecular Chemistry","2008","6","1","81","91","10.1039/b713888a","","","0.75","synchrotron","","0.1272","0.1169","","","0.2928","0.3156","","","","","","3.024","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150809","12.1762","0.0002","17.4387","0.0002","20.106","0.0001","80.239","0.001","73.766","0.001","73.137","0.001","3904.56","0.09","200","2","200","2","","","","","","","","4","P -1","-P 1","2","in paper 2c","","","- C35 H25 N O -","- C35 H25 N O -","- C210 H150 N6 O6 -","6","3","","D'Souza, Daniel M.; Liao, Wei-Wei; Rominger, Frank; Müller, Thomas J. J.","Dichotomies in microwave-assisted propargyl-isomerization‒Claisen domino sequences dependent on base strengths","Organic & Biomolecular Chemistry","2008","6","3","532","539","10.1039/b714351f","","","0.71073","MoKα","","0.0792","0.049","","","0.1072","0.1238","","","","","","1.026","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150810","8.519","0.0002","12.585","0.0003","10.241","0.0001","73.057","0.0011","86.768","0.0012","98.877","0.0009","1031.73","0.04","200","2","200","2","","","","","","","","3","P -1","-P 1","2","in paper 5e","","","- C29 H24 O -","- C29 H24 O -","- C58 H48 O2 -","2","1","","D'Souza, Daniel M.; Liao, Wei-Wei; Rominger, Frank; Müller, Thomas J. J.","Dichotomies in microwave-assisted propargyl-isomerization‒Claisen domino sequences dependent on base strengths","Organic & Biomolecular Chemistry","2008","6","3","532","539","10.1039/b714351f","","","0.71073","MoKα","","0.084","0.0484","","","0.1122","0.1307","","","","","","0.996","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150811","15.348","0.002","8.806","0.001","22.612","0.004","90","","109.831","0.003","90","","2874.9","0.7","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","in paper 2a","","","- C37 H31 N O4 -","- C37 H31 N O4 -","- C148 H124 N4 O16 -","4","1","","D'Souza, Daniel M.; Liao, Wei-Wei; Rominger, Frank; Müller, Thomas J. J.","Dichotomies in microwave-assisted propargyl-isomerization‒Claisen domino sequences dependent on base strengths","Organic & Biomolecular Chemistry","2008","6","3","532","539","10.1039/b714351f","","","0.71073","MoKα","","0.0685","0.048","","","0.1073","0.1164","","","","","","1.043","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150812","15.277","0.003","37.64","0.008","7.251","0.002","90","","90","","90","","4169.5","1.7","200","2","200","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","in paper 11f","","","- C29 H24 O2 -","- C29 H24 O2 -","- C232 H192 O16 -","8","1","","D'Souza, Daniel M.; Liao, Wei-Wei; Rominger, Frank; Müller, Thomas J. J.","Dichotomies in microwave-assisted propargyl-isomerization‒Claisen domino sequences dependent on base strengths","Organic & Biomolecular Chemistry","2008","6","3","532","539","10.1039/b714351f","","","0.71073","MoKα","","0.0848","0.0612","","","0.1327","0.1415","","","","","","1.081","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150813","9.82","0.03","9.82","0.03","16.09","0.03","90","","101.08","0.16","90","","1523","7","296.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","'N-((1S, 3S)-2,2-dichloro-1,3-dimethylcyclopropanecarbonyl)- (1S)-1-phenylethylam","","","- C14 H17 Cl2 N O -","- C14 H17 Cl2 N O -","- C56 H68 Cl8 N4 O4 -","4","2","","Yasukochi, Hiroaki; Atago, Takayuki; Tanaka, Akihiro; Nakatsuji, Hidefumi; Yoshida, Eri; Kakehi, Akikazu; Nishii, Yoshinori; Tanabe, Yoo","Practical, general, and systematic method for optical resolution of gem-dihalo- and monohalocyclopropanecarboxylic acids utilizing chiral 1,1′-binaphtholmonomethyl ethers: Application to the synthesis of three chiral pesticides","Organic & Biomolecular Chemistry","2008","6","3","540","547","10.1039/b714614k","","","0.71069","MoKα","","","0.0601","","","","0.2149","","","","","","0.955","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150814","14.5931","0.0006","21.5413","0.0008","8.0149","0.0003","90","","90","","90","","2519.52","0.17","0","2","0","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C28 H30 N2 O3 S2 -","- C28 H30 N2 O3 S2 -","- C112 H120 N8 O12 S8 -","4","1","","Cheruku, Pradeep; Paptchikhine, Alexander; Ali, Muhammad; Neudörfl, Jörg-M.; Andersson, Pher G.","Development of new thiazole-based iridium catalysts and their applications in the asymmetric hydrogenation of trisubstituted olefins","Organic & Biomolecular Chemistry","2008","6","2","366","373","10.1039/b714744a","","","0.71073","MoKα","","0.0748","0.0465","","","0.0861","0.0939","","","","","","0.99","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150815","8.43","0.001","16.304","0.001","20.801","0.001","90","","90","","90","","2858.9","0.4","180","2","180","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H46 O5 Si -","- C28 H46 O5 Si -","- C112 H184 O20 Si4 -","4","1","","Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.","The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles","Organic & Biomolecular Chemistry","2008","6","4","693","702","10.1039/b715354f","","","0.71073","MoKα","","0.0655","0.0417","","","0.098","0.1255","","","","","","1.135","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150816","10.819","0.0004","5.371","0.0001","15.64","0.0005","90","","102.809","0.0016","90","","886.21","0.05","180","2","180","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H26 O4 -","- C19 H26 O4 -","- C38 H52 O8 -","2","1","","Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.","The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles","Organic & Biomolecular Chemistry","2008","6","4","693","702","10.1039/b715354f","","","0.71073","MoKα","","0.0708","0.0603","","","0.1606","0.1765","","","","","","1.098","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150817","7.8054","0.0005","10.1991","0.0009","14.3886","0.0006","90","","90","","90","","1145.45","0.13","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H14 O5 -","- C12 H14 O5 -","- C48 H56 O20 -","4","1","","Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.","The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles","Organic & Biomolecular Chemistry","2008","6","4","693","702","10.1039/b715354f","","","0.6884","Synchrotron","","0.0506","0.0436","","","0.1078","0.1104","","","","","","1.143","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150818","8.04","0.003","16.929","0.003","19.604","0.003","90","","90","","90","","2668.3","1.2","180","2","180","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H44 O5 Si -","- C26 H44 O5 Si -","- C104 H176 O20 Si4 -","4","1","","Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.","The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles","Organic & Biomolecular Chemistry","2008","6","4","693","702","10.1039/b715354f","","","0.71073","MoKα","","0.0741","0.046","","","0.1233","0.1699","","","","","","1.246","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150819","7.72","0.004","6.415","0.003","12.126","0.005","90","","96.616","0.011","90","","596.5","0.5","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H16 O4 -","- C13 H16 O4 -","- C26 H32 O8 -","2","1","","Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.","The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles","Organic & Biomolecular Chemistry","2008","6","4","693","702","10.1039/b715354f","","","0.6891","Synchrotron","","0.0603","0.0455","","","0.1179","0.12","","","","","","1.041","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150820","14.3428","0.0007","14.3428","0.0007","8.9246","0.0004","90","","90","","120","","1589.96","0.13","150","2","150","2","","","","","","","","3","P 63","P 6c","173","","","","- C11 H16 O4 -","- C11 H16 O4 -","- C66 H96 O24 -","6","1","","Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.","The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles","Organic & Biomolecular Chemistry","2008","6","4","693","702","10.1039/b715354f","","","0.6884","Synchrotron","","0.0345","0.0325","","","0.0869","0.0875","","","","","","1.191","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150821","8.279","0.003","8.724","0.003","9.245","0.004","97.164","0.008","94.153","0.008","116.289","0.008","587.8","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H30 Mg O10 -","- C22 H30 Mg O10 -","- C22 H30 Mg O10 -","1","0.5","","Bernat, Virginie; André, Chantal; André-Barrès, Christiane","Weak chemiluminescence emission during base induced rearrangement of G-factors","Organic & Biomolecular Chemistry","2008","6","3","454","457","10.1039/b715491g","","","0.71073","MoKα","","0.1287","0.06","","","0.1115","0.1347","","","","","","0.921","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150822","11.4202","0.0007","13.2038","0.0008","13.6607","0.0008","106.538","0.001","90.402","0.001","115.04","0.001","1769.71","0.19","100","1","100","1","","","","","","","see text","2","P -1","-P 1","2","","","","- C24 H28 -","- C24 H28 -","- C96 H112 -","4","2","","Pollard, Michael M.; Meetsma, Auke; Feringa, Ben L.","A redesign of light-driven rotary molecular motors","Organic & Biomolecular Chemistry","2008","6","3","507","512","10.1039/b715652a","","","0.71073","MoKα","","0.0612","0.0496","","","0.1176","0.124","","","","","","1.033","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150823","38.531","0.009","5.981","0.001","16.016","0.004","90","","93.416","0.004","90","","3684.4","1.4","100","1","100","1","","","","","","","see text","2","C 1 2/c 1","-C 2yc","15","","","","- C24 H28 -","- C24 H28 -","- C192 H224 -","8","1","","Pollard, Michael M.; Meetsma, Auke; Feringa, Ben L.","A redesign of light-driven rotary molecular motors","Organic & Biomolecular Chemistry","2008","6","3","507","512","10.1039/b715652a","","","0.71073","MoKα","","0.0566","0.0451","","","0.1137","0.1211","","","","","","1.02","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150824","7.9098","0.0008","16.815","0.0018","8.1247","0.0008","90","","91.953","0.007","90","","1079.98","0.19","150","","150","","","","","","","","Oscar Prieto reaction OP411","5","P 1 21 1","P 2yb","4","","","","- C22 H28 N2 O5 S -","- C22 H28 N2 O5 S -","- C44 H56 N4 O10 S2 -","2","1","","Prieto, Oscar; Lam, Hon Wai","Cobalt-catalyzed reductive Mannich reactions of 4-acryloylmorpholine with N-tosyl aldimines","Organic & Biomolecular Chemistry","2008","6","1","55","57","10.1039/b715839d","","","0.71073","MoKα","","0.083","0.0569","","0.1155","0.1052","0.1155","","","","","","0.8677","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150825","5.9601","0.0001","9.7146","0.0002","16.6249","0.0003","100.634","0.001","100.386","0.001","99.836","0.001","909.57","0.03","150","","150","","","","","","","","Oscar Prieto OP-406 major diast","5","P -1","-P 1","2","","","","- C18 H22 N2 O4 S2 -","- C18 H22 N2 O4 S2 -","- C36 H44 N4 O8 S4 -","2","1","","Prieto, Oscar; Lam, Hon Wai","Cobalt-catalyzed reductive Mannich reactions of 4-acryloylmorpholine with N-tosyl aldimines","Organic & Biomolecular Chemistry","2008","6","1","55","57","10.1039/b715839d","","","0.71073","MoKα","","0.046","0.0368","","0.1019","0.0991","0.1019","","","","","","0.9635","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7150826","22.1667","0.0013","25.5085","0.0013","7.5733","0.0004","90","","90","","90","","4282.2","0.4","150","","150","","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C22 H28 N2 O5 S -","- C22 H28 N2 O5 S -","- C176 H224 N16 O40 S8 -","8","1","","Prieto, Oscar; Lam, Hon Wai","Cobalt-catalyzed reductive Mannich reactions of 4-acryloylmorpholine with N-tosyl aldimines","Organic & Biomolecular Chemistry","2008","6","1","55","57","10.1039/b715839d","","","0.71073","MoKα","","0.0744","0.0464","","0.0867","0.0745","0.0867","","","","","","0.9294","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150827","11.949","0.002","9.313","0.001","15.289","0.003","90","","101.84","0.02","90","","1665.2","0.5","300","2","300","2","","","","","","","","5","P 1 21 1","P 2yb","4","Acetic acid 1R,8S,9R,11R,13R,20R-9-acetoxy-11,22-bis-(2,2,2- trifluoro-acetylamino)-2,7,14,19-tetraoxa- tricyclo(18.3.1.08,13)tetracos-24-yl ester","Acetic acid 1R,8S,9R,11R,13R,20R-9-acetoxy-11,22-bis-(2,2,2-trifluoro-acetylamino)- 2,7,14,19-tetraoxa-tricyclo[18.3.1.08,13]tetracos-24-yl ester","","- C28 H40 F6 N2 O10 -","- C28 H40 F6 N2 O10 -","- C56 H80 F12 N4 O20 -","2","1","","Oelze, Benjamin; Albert, Dieter; Kirschning, Andreas","Synthetic and structural studies on macrocyclic amino cyclitols ‒ conformational chameleons","Organic & Biomolecular Chemistry","2008","6","13","2412","2425","10.1039/b716347a","","","0.71073","MoKα","","0.1769","0.0447","","","0.0593","0.073","","","","","","0.588","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150828","11.4747","0.0013","6.7238","0.0007","15.8519","0.0019","90","","97.2644","0.0018","90","","1213.2","0.2","90","","90","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H30 N4 O13 Os -","- C20 H22 N4 O13 Os -","- C40 H44 N8 O26 Os2 -","2","1","","Umemoto, Tadashi; Okamoto, Akimitsu","Synthesis and characterization of the 5-methyl-2′-deoxycytidine glycol‒dioxoosmium‒bipyridine ternary complex in DNA","Organic & Biomolecular Chemistry","2008","6","2","269","271","10.1039/b716400a","","","0.71073","MoKα","","0.0212","0.0176","","","0.045","0.0456","","","","","","1.013","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150829","6.7091","0.0002","8.077","0.0002","13.7233","0.0004","103.96","0.0017","93.8881","0.0018","109.004","0.0018","673.62","0.03","200","","200","","","","","","","","?","4","P -1","-P 1","2","","","","- C15 H13 Br O4 -","- C15 H13 Br O4 -","- C30 H26 Br2 O8 -","2","1","","Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.","Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes","Organic & Biomolecular Chemistry","2008","6","3","513","522","10.1039/b716910h","","","0.71073","MoKα","","0.0345","0.0272","","0.0356","0.0321","0.0321","","","","","","1.0615","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150830","44.1595","0.0017","6.5892","0.0002","30.3735","0.0011","90","","127.205","0.0011","90","","7039.2","0.4","200","","200","","","","","","","","local","4","C 1 2/c 1","-C 2yc","15","","","","- C18 H22 O4 Si -","- C18 H22 O4 Si -","- C288 H352 O64 Si16 -","16","2","","Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.","Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes","Organic & Biomolecular Chemistry","2008","6","3","513","522","10.1039/b716910h","","","0.71073","MoKα","","0.0761","0.0394","","0.0487","0.041","0.041","","","","","","1.1512","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150831","9.308","0.0002","10.106","0.0002","14.4185","0.0003","90","","95.7272","0.0012","90","","1349.53","0.05","200","","200","","","","","","","","?","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H13 Br O4 -","- C15 H13 Br O4 -","- C60 H52 Br4 O16 -","4","1","","Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.","Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes","Organic & Biomolecular Chemistry","2008","6","3","513","522","10.1039/b716910h","","","0.71073","MoKα","","0.0266","0.0208","","0.0264","0.0233","0.0233","","","","","","1.1202","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150832","9.3794","0.0002","9.9026","0.0002","10.4159","0.0002","86.4869","0.0012","66.0202","0.0013","79.5571","0.0015","869.21","0.03","200","","200","","","","","","","","?","4","P -1","-P 1","2","","","","- C18 H22 O4 Si -","- C18 H22 O4 Si -","- C36 H44 O8 Si2 -","2","1","","Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.","Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes","Organic & Biomolecular Chemistry","2008","6","3","513","522","10.1039/b716910h","","","0.71073","MoKα","","0.0462","0.0353","","0.0392","0.0371","0.0371","","","","","","1.0878","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150833","11.7777","0.0005","5.4798","0.0001","20.1905","0.0006","90","","90","","90","","1303.08","0.07","200","","200","","","","","","","","local","3","P n a 21","P 2c -2n","33","","","","- C16 H12 O6 -","- C16 H12 O6 -","- C64 H48 O24 -","4","1","","Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.","Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes","Organic & Biomolecular Chemistry","2008","6","3","513","522","10.1039/b716910h","","","0.71073","MoKα","","0.03","0.026","","0.0333","0.0312","0.0312","","","","","","1.1445","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150834","8.3666","0.0002","15.4945","0.0003","16.3029","0.0004","90","","90","","90","","2113.45","0.08","173","2","173","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C17 H27 Cu F6 N3 O4 -","- C17 H27 Cu F6 N3 O4 -","- C68 H108 Cu4 F24 N12 O16 -","4","1","","Stones, Graham; Tripoli, Régis; McDavid, Colin L.; Roux-Duplâtre, Kewin; Kennedy, Alan R.; Sherrington, David C.; Gibson, Colin L.","Investigation of macrocyclisation routes to 1,4,7-triazacyclononanes: efficient syntheses from 1,2-ditosylamides","Organic & Biomolecular Chemistry","2008","6","2","374","384","10.1039/b716938h","","","0.71073","MoKα","","0.0701","0.0405","","","0.063","0.0719","","","","","","1.033","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150835","8.5196","0.0002","11.9778","0.0003","11.9934","0.0003","90","","90.014","0.0015","90","","1223.88","0.05","150","","150","","","","","","","","synthesis as described in manuscriptCCDC","4","P 1 21/n 1","-P 2yn","14","2-tert-butylsulfinyl-3-methoxyphenylmethanol","2-tert-butylsulfinyl-3-methoxyphenylmethanol","","- C12 H18 O3 S -","- C12 H18 O3 S -","- C48 H72 O12 S4 -","4","1","","Flemming, Jonathan P.; Berry, Malcolm B.; Brown, John M.","Sequential ortho-lithiations; the sulfoxide group as a relay to enable meta-substitution","Organic & Biomolecular Chemistry","2008","6","7","1215","1221","10.1039/B716954j","","","0.71073","MoKα","","0.0417","0.0308","","0.0439","0.0368","0.0368","","","","","","1.0472","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150836","8.8092","0.0005","11.8522","0.0007","11.5256","0.0007","90","","91.543","0.002","90","","1202.93","0.12","150","","150","","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H16 O3 S -","- C12 H16 O3 S -","- C48 H64 O12 S4 -","4","1","","Flemming, Jonathan P.; Berry, Malcolm B.; Brown, John M.","Sequential ortho-lithiations; the sulfoxide group as a relay to enable meta-substitution","Organic & Biomolecular Chemistry","2008","6","7","1215","1221","10.1039/B716954j","","","0.71073","MoKα","","0.0859","0.0419","","0.0673","0.0478","0.0478","","","","","","1.0871","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150837","8.445","0.0003","12.0343","0.0004","11.7417","0.0004","90","","91.0936","0.0016","90","","1193.09","0.07","150","","150","","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C12 H18 O2 S -","- C12 H18 O2 S -","- C48 H72 O8 S4 -","4","1","","Flemming, Jonathan P.; Berry, Malcolm B.; Brown, John M.","Sequential ortho-lithiations; the sulfoxide group as a relay to enable meta-substitution","Organic & Biomolecular Chemistry","2008","6","7","1215","1221","10.1039/B716954j","","","0.71073","MoKα","","0.0446","0.0326","","0.0494","0.0442","0.0442","","","","","","0.9915","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150838","5.9329","0.0008","14.5318","0.0019","18.898","0.003","90","","90","","90","","1629.3","0.4","566","2","566","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Tricyclic compounds","","","- C14 H15.3 N5 O6.15 -","- C14 H15 N5 O6.15 -","- C56 H60 N20 O24.6 -","4","1","","Anegundi, Ramakrishna I.; Puranik, Vedavati G.; Hotha, Srinivas","Synthesis of 1,2,3-triazole and 1,2,3,4-tetrazole-fused glycosides and nucleosides by an intramolecular 1,3-dipolar cycloaddition reaction","Organic & Biomolecular Chemistry","2008","6","4","779","786","10.1039/b716996e","","","0.71073","MoKα","","0.1687","0.0607","","","0.1058","0.1471","","","","","","0.977","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150839","5.6672","0.0005","9.8214","0.0009","21.2188","0.0019","90","","90","","90","","1181.03","0.18","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Tetracyclic compounds","","","- C10 H14 N4 O4 -","- C10 H14 N4 O4 -","- C40 H56 N16 O16 -","4","1","","Anegundi, Ramakrishna I.; Puranik, Vedavati G.; Hotha, Srinivas","Synthesis of 1,2,3-triazole and 1,2,3,4-tetrazole-fused glycosides and nucleosides by an intramolecular 1,3-dipolar cycloaddition reaction","Organic & Biomolecular Chemistry","2008","6","4","779","786","10.1039/b716996e","","","0.71073","MoKα","","0.0478","0.0406","","","0.09","0.0935","","","","","","1.079","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150840","5.495","0.001","10.054","0.002","21.33","0.004","90","","90","","90","","1178.4","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H15 N3 O4 -","- C11 H15 N3 O4 -","- C44 H60 N12 O16 -","4","1","","Anegundi, Ramakrishna I.; Puranik, Vedavati G.; Hotha, Srinivas","Synthesis of 1,2,3-triazole and 1,2,3,4-tetrazole-fused glycosides and nucleosides by an intramolecular 1,3-dipolar cycloaddition reaction","Organic & Biomolecular Chemistry","2008","6","4","779","786","10.1039/b716996e","","","0.71073","MoKα","","0.0686","0.0283","","","0.0306","0.0357","","","","","","0.541","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150841","12.595","0.003","6.1165","0.0012","18.862","0.004","90","","106.42","0.03","90","","1393.8","0.6","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C30 H45 N O4 -","- C30 H45 N O4 -","- C60 H90 N2 O8 -","2","1","","Taniguchi, Kayoko; Aruga, Marie; Yasutake, Mikio; Hirose, Takuji","Solvent control of optical resolution of 2-amino-1-phenylethanol using dehydroabietic acid","Organic & Biomolecular Chemistry","2008","6","3","458","463","10.1039/b717071h","","","0.71069","MoKα","","0.1077","0.0672","","","0.1642","0.1885","","","","","","1.106","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150842","10.981","0.002","6.1913","0.0012","17.85","0.004","90","","90.37","0.03","90","","1213.5","0.4","123","2","123","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H39 N O3 -","- C28 H39 N O3 -","- C56 H78 N2 O6 -","2","1","","Taniguchi, Kayoko; Aruga, Marie; Yasutake, Mikio; Hirose, Takuji","Solvent control of optical resolution of 2-amino-1-phenylethanol using dehydroabietic acid","Organic & Biomolecular Chemistry","2008","6","3","458","463","10.1039/b717071h","","","0.71069","MoKα","","0.0701","0.0536","","","0.1332","0.1531","","","","","","0.918","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150843","6.3023","0.0008","19.07","0.002","35.095","0.004","90","","90","","90","","4217.9","0.8","123","2","123","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C48 H67 N O5 -","- C48 H67 N O5 -","- C192 H268 N4 O20 -","4","1","","Taniguchi, Kayoko; Aruga, Marie; Yasutake, Mikio; Hirose, Takuji","Solvent control of optical resolution of 2-amino-1-phenylethanol using dehydroabietic acid","Organic & Biomolecular Chemistry","2008","6","3","458","463","10.1039/b717071h","","","0.71073","MoKα","","0.1378","0.0927","","","0.1999","0.2269","","","","","","1.148","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150844","8.2246","0.0002","8.6176","0.0002","11.5999","0.0003","69.521","0.001","88.202","0.001","85.002","0.001","767.27","0.03","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H13 N4 O7 P -","- C13 H13 N4 O7 P -","- C26 H26 N8 O14 P2 -","2","1","","Griffiths, D. Vaughan; Al-Jeboori, Mohamad J.; Cheong, Yuen-Ki; Duncanson, Philip; Harris, Jayne E.; Salt, Michael C.; Taylor, Helen V.","Electron-rich heteroaroylphosphonates and their reaction with trimethyl phosphite","Organic & Biomolecular Chemistry","2008","6","3","577","585","10.1039/b717130g","","","0.71073","MoKα","","0.0379","0.0345","","","0.1165","0.1213","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150845","4.9892","0.0004","19.2928","0.0014","14.7103","0.0011","90","","99.045","0.001","90","","1398.34","0.18","295","1","295","1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H13 N3 O S -","- C15 H13 N3 O S -","- C60 H52 N12 O4 S4 -","4","1","","Basheer, Ahmad; Rappoport, Zvi","Enols and thioenols of substituted cyanomonothiocarbonylmalonamides: structures, enolization vs. thioenolization, equilibria and conformations","Organic & Biomolecular Chemistry","2008","6","6","1071","1082","10.1039/b717556f","","","0.71073","MoKα","","0.0979","0.0532","","","0.0865","0.0979","","","","","","0.956","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150846","14.6537","0.0011","14.1922","0.0011","14.9966","0.0012","90","","108.831","0.001","90","","2951.9","0.4","295","1","295","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C7 H11 N3 O S -","- C7 H11 N3 O S -","- C84 H132 N36 O12 S12 -","12","3","","Basheer, Ahmad; Rappoport, Zvi","Enols and thioenols of substituted cyanomonothiocarbonylmalonamides: structures, enolization vs. thioenolization, equilibria and conformations","Organic & Biomolecular Chemistry","2008","6","6","1071","1082","10.1039/b717556f","","","0.71073","MoKα","","0.1425","0.1047","","","0.1972","0.2133","","","","","","1.245","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150847","10.5904","0.0006","26.0342","0.0014","9.6563","0.0005","90","","99.047","0.001","90","","2629.2","0.2","295","1","295","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H13 N3 O2 S -","- C12 H13 N3 O2 S -","- C96 H104 N24 O16 S8 -","8","2","","Basheer, Ahmad; Rappoport, Zvi","Enols and thioenols of substituted cyanomonothiocarbonylmalonamides: structures, enolization vs. thioenolization, equilibria and conformations","Organic & Biomolecular Chemistry","2008","6","6","1071","1082","10.1039/b717556f","","","0.71073","MoKα","","0.1764","0.0883","","","0.1344","0.1644","","","","","","1.056","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150848","7.369","0.0004","15.9322","0.0008","10.1036","0.0005","90","","98.626","0.001","90","","1172.79","0.1","295","1","295","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H15 N3 O S -","- C9 H15 N3 O S -","- C36 H60 N12 O4 S4 -","4","1","","Basheer, Ahmad; Rappoport, Zvi","Enols and thioenols of substituted cyanomonothiocarbonylmalonamides: structures, enolization vs. thioenolization, equilibria and conformations","Organic & Biomolecular Chemistry","2008","6","6","1071","1082","10.1039/b717556f","","","0.71073","MoKα","","0.039","0.0371","","","0.1003","0.1019","","","","","","1.037","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150849","8.4053","0.0005","14.8272","0.0009","18.2296","0.0011","90","","90","","90","","2271.9","0.2","293","1","293","1","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H28 N6 O2 S3 -","- C17 H28 N6 O2 S3 -","- C68 H112 N24 O8 S12 -","4","1","","Basheer, Ahmad; Rappoport, Zvi","Enols and thioenols of substituted cyanomonothiocarbonylmalonamides: structures, enolization vs. thioenolization, equilibria and conformations","Organic & Biomolecular Chemistry","2008","6","6","1071","1082","10.1039/b717556f","","","0.71073","MoKα","","0.0332","0.0309","","","0.0689","0.0697","","","","","","1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150850","9.4637","0.0005","9.9527","0.0006","13.2117","0.0008","81.31","0.001","79.178","0.001","68.971","0.001","1136.1","0.11","295","1","295","1","","","","","","","","5","P -1","-P 1","2","","","","- C11 H11 N3 O S -","- C11 H11 N3 O S -","- C44 H44 N12 O4 S4 -","4","2","","Basheer, Ahmad; Rappoport, Zvi","Enols and thioenols of substituted cyanomonothiocarbonylmalonamides: structures, enolization vs. thioenolization, equilibria and conformations","Organic & Biomolecular Chemistry","2008","6","6","1071","1082","10.1039/b717556f","","","0.71073","MoKα","","0.0502","0.0445","","","0.1267","0.1317","","","","","","1.051","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150851","12.321","0.002","18.376","0.003","9.3465","0.0016","90","","116.339","0.003","90","","1896.5","0.5","295","1","295","1","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C20 H21 N3 O S -","- C20 H21 N3 O S -","- C80 H84 N12 O4 S4 -","4","1","","Basheer, Ahmad; Rappoport, Zvi","Enols and thioenols of substituted cyanomonothiocarbonylmalonamides: structures, enolization vs. thioenolization, equilibria and conformations","Organic & Biomolecular Chemistry","2008","6","6","1071","1082","10.1039/b717556f","","","0.71073","MoKα","","0.1637","0.0815","","","0.0973","0.1213","","","","","","0.94","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150852","11.799","0.002","14.9","0.003","21.767","0.004","90","","98.298","0.003","90","","3786.7","1.2","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","Di-tert-butyl 2,6-di((E)-4-isopropylbenzylidene)-4-cyano-4- phenyl-1,7-heptanedioate","Di-tert-butyl 2,6-di[(E)-4-isopropylbenzylidene]- 4-cyano-4-phenyl-1,7-heptanedioate","","- C42 H51 N O4 -","- C42 H51 N O4 -","- C168 H204 N4 O16 -","4","1","","Basavaiah, Deevi; Reddy, Raju Jannapu","Simple and facile synthesis of tetralone-spiro-glutarimides and spiro-bisglutarimides from Baylis‒Hillman acetates","Organic & Biomolecular Chemistry","2008","6","6","1034","1039","10.1039/b717843c","","","0.71073","MoKα","","0.097","0.058","","","0.1491","0.1687","","","","","","1.041","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150853","9.0369","0.0018","25.751","0.005","9.274","0.0018","90","","96.108","0.003","90","","2145.9","0.7","298","","298","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","2,5'-Di((E)-benzylidene)-(1,2,3,4-tetrahydronaphthalen-1-one) 4-spiro-3'-(piperidine-2',6'-dione)","2,5'-Di[(E)-benzylidene]-[1,2,3,4-tetrahydronaphthalen-1-one] 4-spiro-3'-[piperidine-2',6'-dione]","","- C28 H21 N O3 -","- C28 H21 N O3 -","- C112 H84 N4 O12 -","4","1","","Basavaiah, Deevi; Reddy, Raju Jannapu","Simple and facile synthesis of tetralone-spiro-glutarimides and spiro-bisglutarimides from Baylis‒Hillman acetates","Organic & Biomolecular Chemistry","2008","6","6","1034","1039","10.1039/b717843c","","","0.71073","MoKα","","0.0528","0.0427","","","0.1031","0.1081","","","","","","1.065","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150854","9.0278","0.0007","10.5146","0.0009","13.4184","0.0011","79.22","0.001","75.225","0.001","72.025","0.001","1163.34","0.16","298","","298","","","","","","","","","5","P -1","-P 1","2","2,5'-Di((E)-2-chlorobenzylidene)-(1,2,3,4- tetrahydronaphthalen-1-one) 4-spiro-3'-(piperidine-2',6'-dione)","2,5'-Di[(E)-2-chlorobenzylidene]-[1,2,3,4-tetrahydronaphthalen-1-one] 4-spiro-3'-[piperidine-2',6'-dione]","","- C28 H19 Cl2 N O3 -","- C28 H19 Cl2 N O3 -","- C56 H38 Cl4 N2 O6 -","2","1","","Basavaiah, Deevi; Reddy, Raju Jannapu","Simple and facile synthesis of tetralone-spiro-glutarimides and spiro-bisglutarimides from Baylis‒Hillman acetates","Organic & Biomolecular Chemistry","2008","6","6","1034","1039","10.1039/b717843c","","","0.71073","MoKα","","0.0557","0.0412","","","0.1006","0.1064","","","","","","0.997","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150855","10.0689","0.0007","10.7855","0.0008","12.4469","0.0009","101.142","0.001","108.914","0.001","105.628","0.001","1171.6","0.15","298","","298","","","","","","","","","4","P -1","-P 1","2","3,3-Spiro-bis((5-(E)-4-ethylbenzylidene)piperidine-2,6-dione)","3,3-Spiro-bis[{5-(E)-4-ethylbenzylidene}piperidine-2,6-dione]","","- C27 H26 N2 O4 -","- C27 H26 N2 O4 -","- C54 H52 N4 O8 -","2","1","","Basavaiah, Deevi; Reddy, Raju Jannapu","Simple and facile synthesis of tetralone-spiro-glutarimides and spiro-bisglutarimides from Baylis‒Hillman acetates","Organic & Biomolecular Chemistry","2008","6","6","1034","1039","10.1039/b717843c","","","0.71073","MoKα","","0.0803","0.0617","","","0.1824","0.1963","","","","","","1.07","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150856","14.2014","0.0019","15.4184","0.0019","15.7438","0.0017","73.389","0.009","81.409","0.01","66.041","0.009","3016.6","0.7","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C63 H72 Cl6 N6 O6 -","- C63 H72 Cl6 N6 O6 -","- C126 H144 Cl12 N12 O12 -","2","1","","Meshcheryakov, Denys; Arnaud-Neu, Françoise; Böhmer, Volker; Bolte, Michael; Hubscher-Bruder, Véronique; Jobin, Emilie; Thondorf, Iris; Werner, Sabine","Cyclic triureas—synthesis, crystal structures and properties","Organic & Biomolecular Chemistry","2008","6","6","1004","1014","10.1039/b718114k","","","0.71073","MoKα","","0.1506","0.105","","","0.2809","0.3167","","","","","","1.063","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150857","21.973","0.0016","14.2644","0.0006","16.7013","0.0012","90","","96.085","0.006","90","","5205.2","0.6","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C55 H66 Cl N7 O6 -","- C55 H66 Cl N7 O6 -","- C220 H264 Cl4 N28 O24 -","4","1","","Meshcheryakov, Denys; Arnaud-Neu, Françoise; Böhmer, Volker; Bolte, Michael; Hubscher-Bruder, Véronique; Jobin, Emilie; Thondorf, Iris; Werner, Sabine","Cyclic triureas—synthesis, crystal structures and properties","Organic & Biomolecular Chemistry","2008","6","6","1004","1014","10.1039/b718114k","","","0.71073","MoKα","","0.0833","0.0464","","","0.0944","0.1056","","","","","","0.958","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150858","13.819","0.0008","17.9176","0.001","21.6376","0.001","90","","90","","90","","5357.5","0.5","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C55 H66 N6 O9 S2 -","- C55 H66 N6 O9 S2 -","- C220 H264 N24 O36 S8 -","4","1","","Meshcheryakov, Denys; Arnaud-Neu, Françoise; Böhmer, Volker; Bolte, Michael; Hubscher-Bruder, Véronique; Jobin, Emilie; Thondorf, Iris; Werner, Sabine","Cyclic triureas—synthesis, crystal structures and properties","Organic & Biomolecular Chemistry","2008","6","6","1004","1014","10.1039/b718114k","","","0.71073","MoKα","","0.0388","0.0344","","","0.084","0.0859","","","","","","0.989","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150859","12.027","0.002","10.945","0.002","24.151","0.008","90","","105.89","0.03","90","","3057.7","1.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C37 H32 N2 O4 -","- C37 H32 N2 O4 -","- C148 H128 N8 O16 -","4","1","","Ramachary, Dhevalapally B.; Reddy, Y. Vijayendar; Prakash, B. Veda","Double cascade reactions based on the Barbas dienamine platform: highly stereoselective synthesis of functionalized cyclohexanes for cardiovascular agents","Organic & Biomolecular Chemistry","2008","6","4","719","726","10.1039/b718122a","","","0.71073","MoKα","","0.0897","0.0729","","","0.1515","0.1602","","","","","","1.154","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150860","8.336","0.005","11.777","0.009","12.965","0.011","84.71","0.03","83.95","0.03","87.53","0.03","1259.6","1.6","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C13 H13 B F2 N2 O2 -","- C13 H13 B F2 N2 O2 -","- C52 H52 B4 F8 N8 O8 -","4","2","","Maeda, Hiromitsu; Terasaki, Masahiro; Haketa, Yohei; Mihashi, Yuta; Kusunose, Yukio","BF2 complexes of α-alkyl-substituted dipyrrolyldiketones as acyclic anion receptors","Organic & Biomolecular Chemistry","2008","6","3","433","436","10.1039/b718317h","","","0.71075","MoKα","","0.1329","0.0447","","","0.1431","0.193","","","","","","0.918","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150861","9.272","0.011","11.368","0.017","16.05","0.03","98.48","0.05","104.48","0.06","109.8","0.03","1490","4","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H17 B F2 N2 O2 -","- C15 H17 B F2 N2 O2 -","- C60 H68 B4 F8 N8 O8 -","4","2","","Maeda, Hiromitsu; Terasaki, Masahiro; Haketa, Yohei; Mihashi, Yuta; Kusunose, Yukio","BF2 complexes of α-alkyl-substituted dipyrrolyldiketones as acyclic anion receptors","Organic & Biomolecular Chemistry","2008","6","3","433","436","10.1039/b718317h","","","0.71075","MoKα","","0.1228","0.0744","","","0.1738","0.2386","","","","","","0.995","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150862","8.526","0.006","12.16","0.006","8.797","0.005","90","","93.64","0.03","90","","910.2","0.9","123","2","123","2","","","","","","","","6","P 1 c 1","P -2yc","7","","","","- C19 H25 B F2 N2 O2 -","- C19 H25 B F2 N2 O2 -","- C38 H50 B2 F4 N4 O4 -","2","1","","Maeda, Hiromitsu; Terasaki, Masahiro; Haketa, Yohei; Mihashi, Yuta; Kusunose, Yukio","BF2 complexes of α-alkyl-substituted dipyrrolyldiketones as acyclic anion receptors","Organic & Biomolecular Chemistry","2008","6","3","433","436","10.1039/b718317h","","","0.71075","MoKα","","0.0482","0.0376","","","0.0781","0.0895","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150863","27.621","0.008","13.498","0.003","22.643","0.006","90","","128.066","0.01","90","","6646","3","123","2","123","2","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C31 H53 B Cl F2 N3 O2 -","- C31 H53 B Cl F2 N3 O2 -","- C248 H424 B8 Cl8 F16 N24 O16 -","8","1","","Maeda, Hiromitsu; Terasaki, Masahiro; Haketa, Yohei; Mihashi, Yuta; Kusunose, Yukio","BF2 complexes of α-alkyl-substituted dipyrrolyldiketones as acyclic anion receptors","Organic & Biomolecular Chemistry","2008","6","3","433","436","10.1039/b718317h","","","0.71075","MoKα","","0.1324","0.1199","","","0.3261","0.3307","","","","","","1.083","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150864","10.584","0.003","10.448","0.003","14.677","0.004","90","","90.31","0.011","90","","1623","0.8","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H12 F3 N3 O5 -","- C17 H12 F3 N3 O5 -","- C68 H48 F12 N12 O20 -","4","1","","Boyd, Derek R.; Sharma, Narain D.; Harrison, John S.; Malone, John. F.; McRoberts, W. Colin; Hamilton, John T. G.; Harper, David B.","Enzyme-catalysed synthesis and reactions of benzene oxide/oxepine derivatives of methyl benzoates","Organic & Biomolecular Chemistry","2008","6","7","1251","1259","10.1039/b718375e","","","0.71073","MoKα","","0.0851","0.0719","","","0.2173","0.233","","","","","","1.137","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150865","14.4683","0.0009","17.0943","0.0011","4.92","0.0002","90","","90","","90","","1216.84","0.12","113","2","108","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C14 H10 B Br O2 -","- C14 H10 B Br O2 -","- C56 H40 B4 Br4 O8 -","4","1","","Filthaus, Matthias; Oppel, Iris M.; Bettinger, Holger F.","Supramolecular structures and spontaneous resolution: the case of ortho-substituted phenylboronic acids","Organic & Biomolecular Chemistry","2008","6","7","1201","1207","10.1039/b719282g","","","0.71073","MoKα","","0.0323","0.024","","","0.048","0.049","","","","","","0.955","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150866","31.502","0.003","7.6126","0.0006","12.1156","0.0007","90","","110.098","0.012","90","","2728.5","0.4","293","2","294","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H15 B O2 -","- C16 H15 B O2 -","- C128 H120 B8 O16 -","8","1","","Filthaus, Matthias; Oppel, Iris M.; Bettinger, Holger F.","Supramolecular structures and spontaneous resolution: the case of ortho-substituted phenylboronic acids","Organic & Biomolecular Chemistry","2008","6","7","1201","1207","10.1039/b719282g","","","0.71073","MoKα","","0.077","0.053","","","0.1391","0.1597","","","","","","1.012","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150867","4.957","0.0008","7.056","0.001","10.7572","0.0017","95.766","0.012","92.219","0.013","96.613","0.013","371.37","0.1","108","2","108","2","","","","","","","","5","P -1","-P 1","2","","","","- C6 H6 B Br O2 -","- C6 H6 B Br O2 -","- C12 H12 B2 Br2 O4 -","2","1","","Filthaus, Matthias; Oppel, Iris M.; Bettinger, Holger F.","Supramolecular structures and spontaneous resolution: the case of ortho-substituted phenylboronic acids","Organic & Biomolecular Chemistry","2008","6","7","1201","1207","10.1039/b719282g","","","0.71073","MoKα","","0.027","0.0241","","","0.0589","0.0595","","","","","","1.045","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150868","8.2637","0.0009","9.2893","0.0008","14.5479","0.0019","98.514","0.009","104.995","0.01","99.904","0.009","1040.7","0.2","108","2","108","2","","","","","","","","4","P -1","-P 1","2","","","","- C12 H11 B O2 -","- C12 H11 B O2 -","- C48 H44 B4 O8 -","4","2","","Filthaus, Matthias; Oppel, Iris M.; Bettinger, Holger F.","Supramolecular structures and spontaneous resolution: the case of ortho-substituted phenylboronic acids","Organic & Biomolecular Chemistry","2008","6","7","1201","1207","10.1039/b719282g","","","0.71073","MoKα","","0.1072","0.0615","","","0.1427","0.159","","","","","","0.863","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150869","31.624","0.004","15.1613","0.0014","9.1559","0.0014","90","","90","","90","","4389.9","1","108","2","108","2","","","","","","","","4","A b a 2","A 2 -2ab","41","","","","- C11 H17 B O2 -","- C11 H17 B O2 -","- C176 H272 B16 O32 -","16","","","Filthaus, Matthias; Oppel, Iris M.; Bettinger, Holger F.","Supramolecular structures and spontaneous resolution: the case of ortho-substituted phenylboronic acids","Organic & Biomolecular Chemistry","2008","6","7","1201","1207","10.1039/b719282g","","","0.71073","MoKα","","0.0502","0.0406","","","0.0989","0.1014","","","","","","1.076","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150870","7.5917","0.0005","17.728","0.0011","14.962","0.001","90","","98.148","0.006","90","","1993.3","0.2","170","2","170","2","","","","","","","","5","P 1 21 1","P 2yb","4","Bis2,6pyr-cyclen","","","- C23 H64 Cl7 N9 O6 -","- C23 H62 Cl7 N9 O6 -","- C46 H124 Cl14 N18 O12 -","2","1","","Delépine, Anne-Sophie; Tripier, Raphaël; Handel, Henri","Cyclen-based bismacrocycles for biological anion recognition. A potentiometric and NMR study of AMP, ADP and ATP nucleotide complexation","Organic & Biomolecular Chemistry","2008","6","10","1743","1750","10.1039/b719514a","","x-ray","0.71073","MoKα","","0.0639","0.0482","","","0.1238","0.1323","","","","","","1.015","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150871","19.246","0.006","5.8447","0.0016","14.509","0.005","90","","129.844","0.004","90","","1253.1","0.7","223","2","223","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C16 H15 N O -","- C16 H15 N O -","- C64 H60 N4 O4 -","4","1","","Xu, Zhou; Mao, Jincheng; Zhang, Yawen","Highly enantioselective alkynylation of aldehydes catalyzed by a new oxazolidine‒titanium complex","Organic & Biomolecular Chemistry","2008","6","7","1288","1292","10.1039/b719624e","","","0.7107","MoKα","","0.033","0.0315","","","0.0792","0.0802","","","","","","1.084","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150872","14.505","0.001","10.7366","0.0007","10.6755","0.001","90","","100.855","0.007","90","","1632.8","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N O4 -","- C18 H19 N O4 -","- C72 H76 N4 O16 -","4","1","","Vara, Yosu; Aldaba, Eneko; Arrieta, Ana; Pizarro, José L.; Arriortua, María I.; Cossío, Fernando P.","Regiochemistry of the microwave-assisted reaction between aromatic amines and α-bromoketones to yield substituted 1H-indoles","Organic & Biomolecular Chemistry","2008","6","10","1763","1772","10.1039/b719641e","","","0.71073","MoKα","","0.1049","0.0584","","","0.1164","0.1363","","","","","","1.134","","","","has coordinates","206958","2020-10-21","18:00:00",""
"7150873","11.3216","0.0001","13.2699","0.0001","13.7391","0.0002","90","","90","","90","","2064.11","0.04","298","","298","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H25 N3 O4 -","- C22 H25 N3 O4 -","- C88 H100 N12 O16 -","4","1","","Sakamoto, Masami; Sato, Naoto; Mino, Takashi; Kasashima, Yoshio; Fujita, Tsutomu","Crystallization-induced diastereomer transformation of 2-quinolone-4-carboxamide followed by stereoselective intermolecular photocycloaddition reaction","Organic & Biomolecular Chemistry","2008","6","5","848","850","10.1039/b719761f","","","0.71073","MoKα","","0.0721","0.048","","","0.1187","0.1295","","","","","","0.98","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150874","8.0817","0.001","14.5195","0.0018","17.141","0.002","90","","90","","90","","2011.4","0.4","90","","90","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H25 N3 O4 -","- C22 H25 N3 O4 -","- C88 H100 N12 O16 -","4","1","","Sakamoto, Masami; Sato, Naoto; Mino, Takashi; Kasashima, Yoshio; Fujita, Tsutomu","Crystallization-induced diastereomer transformation of 2-quinolone-4-carboxamide followed by stereoselective intermolecular photocycloaddition reaction","Organic & Biomolecular Chemistry","2008","6","5","848","850","10.1039/b719761f","","","0.71073","MoKα","","0.037","0.033","","","0.0809","0.0832","","","","","","1.016","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150875","5.35","","8.79","","10.58","","111.47","","94.77","","94.31","","458.412","","293","","293","","","","","","","","","4","P -1","-P 1","2","","","","- C9 H6 N2 O5 -","- C9 H6 N2 O5 -","- C18 H12 N4 O10 -","2","1","","Mahiout, Zahia; Lomberget, Thierry; Goncalves, Sylvie; Barret, Roland","Solvent-dependent oxidations of 5- and 6-azaindoles to trioxopyrrolopyridines and functionalised azaindoles","Organic & Biomolecular Chemistry","2008","6","8","1364","1376","10.1039/b719776d","","x-ray","0.71073","MoKα","","0.1193","0.0467","","0.115","0.0567","0.0567","","","","","","1.0578","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150876","8.5186","0.0006","14.4133","0.0011","19.634","0.0015","90","","90","","90","","2410.7","0.3","294","2","294","2","","","","","","","","3","P c a 21","P 2c -2ac","29","","","","- C26 H28 O8 -","- C26 H28 O8 -","- C104 H112 O32 -","4","1","","Guan, Zheng-Hui; Ren, Zhi-Hui; Zhao, Lian-Biao; Liang, Yong-Min","Palladium-catalyzed synthesis of indene derivatives via propargylic carbonates with in situ generated organozinc compounds","Organic & Biomolecular Chemistry","2008","6","6","1040","1045","10.1039/b719957k","","","0.71073","MoKα","","0.0676","0.0449","","","0.1131","0.1276","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150877","5.334","0.004","9.149","0.007","13.947","0.013","74.6","0.03","80.12","0.03","82.77","0.02","644.1","0.9","200","","200","","","","","","","","","4","P -1","-P 1","2","","","","- C14 H17 N O3 -","- C14 H17 N O3 -","- C28 H34 N2 O6 -","2","1","","Matsuhira, Takashi; Yamamoto, Hitoshi; Okamura, Taka-aki; Ueyama, Norikazu","Manipulation of an intramolecular NH⋯O hydrogen bond by photoswitching between stable E/Z isomers of the cinnamate framework","Organic & Biomolecular Chemistry","2008","6","11","1926","1933","10.1039/b719960k","","","0.71075","MoKα","","0.0772","0.039","","","0.0692","0.0734","","","","","","1.001","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150878","21.127","0.005","21.127","0.005","7.5223","0.0015","90","","90","","120","","2907.7","1.1","200","","200","","","","","","","","","4","P 63","P 6c","173","","","","- C18 H28 N2 O3 -","- C18 H28 N2 O3 -","- C108 H168 N12 O18 -","6","1","","Matsuhira, Takashi; Yamamoto, Hitoshi; Okamura, Taka-aki; Ueyama, Norikazu","Manipulation of an intramolecular NH⋯O hydrogen bond by photoswitching between stable E/Z isomers of the cinnamate framework","Organic & Biomolecular Chemistry","2008","6","11","1926","1933","10.1039/b719960k","","","0.71075","MoKα","","0.0538","0.0408","","","0.0928","0.0982","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150879","6.6262","0.0018","16.496","0.005","21.207","0.005","90","","90","","90","","2318","1.1","93","2","93","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H23 N O3 S -","- C28 H23 N O3 S -","- C112 H92 N4 O12 S4 -","4","1","","Duguet, Nicolas; Campbell, Craig D.; Slawin, Alexandra M. Z.; Smith, Andrew D.","N-Heterocyclic carbene catalysed β-lactam synthesis","Organic & Biomolecular Chemistry","2008","6","6","1108","1113","10.1039/b800857b","","","0.71073","MoKα","","0.0837","0.0687","","","0.162","0.1741","","","","","","1.084","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150880","9.5372","0.0005","11.0197","0.0006","16.2672","0.0009","90","","92.323","0.002","90","","1708.23","0.16","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C33 H54 O7 Si -","- C33 H54 O7 Si -","- C66 H108 O14 Si2 -","2","1","","Pattenden, Gerald; Ashweek, Neil J.; Baker-Glenn, Charles A. G.; Kempson, James; Walker, Gary M.; Yee, James G. K.","Total synthesis of (−)-ulapualide A, a novel tris-oxazole macrolide from marine nudibranchs, based on some biosynthesis speculation","Organic & Biomolecular Chemistry","2008","6","8","1478","1497","10.1039/b801036f","","","0.71073","MoKα","","0.0323","0.0312","","","0.0865","0.0878","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150881","10.1826","0.0008","9.5473","0.0007","10.2926","0.0011","90","","103.133","0.003","90","","974.44","0.15","293","2","293","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C17 H27 N3 O4 -","- C17 H27 N3 O4 -","- C34 H54 N6 O8 -","2","1","","Fischer, Lucile; Didierjean, Claude; Jolibois, Franck; Semetey, Vincent; Manuel Lozano, Jose; Briand, Jean-Paul; Marraud, Michel; Poteau, Romuald; Guichard, Gilles","Propensity for local folding induced by the urea fragment in short-chain oligomers","Organic & Biomolecular Chemistry","2008","6","14","2596","2610","","","x-ray","0.7107","MoKα","","0.0984","0.0642","","","0.1654","0.1908","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150882","10.185","0.0012","9.447","0.0007","10.571","0.002","90","","103.216","0.004","90","","990.2","0.2","293","2","293","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C17 H32 N4 O3 -","- C17 H32 N4 O3 -","- C34 H64 N8 O6 -","2","1","","Fischer, Lucile; Didierjean, Claude; Jolibois, Franck; Semetey, Vincent; Manuel Lozano, Jose; Briand, Jean-Paul; Marraud, Michel; Poteau, Romuald; Guichard, Gilles","Propensity for local folding induced by the urea fragment in short-chain oligomers","Organic & Biomolecular Chemistry","2008","6","14","2596","2610","","","x-ray","0.7107","MoKα","","0.0747","0.045","","","0.1102","0.125","","","","","","1.021","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150883","9.4284","0.0002","15.824","0.0003","21.002","0.0005","90","","98.536","0.002","90","","3098.68","0.12","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H25 N3 O3 -","- C13 H25 N3 O3 -","- C104 H200 N24 O24 -","8","2","","Fischer, Lucile; Didierjean, Claude; Jolibois, Franck; Semetey, Vincent; Manuel Lozano, Jose; Briand, Jean-Paul; Marraud, Michel; Poteau, Romuald; Guichard, Gilles","Propensity for local folding induced by the urea fragment in short-chain oligomers","Organic & Biomolecular Chemistry","2008","6","14","2596","2610","10.1039/b801139g","","x-ray","0.71073","MoKα","","0.1189","0.0517","","","0.128","0.1544","","","","","","0.95","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150884","20.565","0.005","5.223","0.001","17.23","0.004","90","","105.921","0.008","90","","1779.7","0.7","293","2","293","2","","","","","","","synthesis as described","4","C 1 2 1","C 2y","5","","","","- C16 H25 N3 O3 -","- C16 H25 N3 O3 -","- C64 H100 N12 O12 -","4","1","","Fischer, Lucile; Didierjean, Claude; Jolibois, Franck; Semetey, Vincent; Manuel Lozano, Jose; Briand, Jean-Paul; Marraud, Michel; Poteau, Romuald; Guichard, Gilles","Propensity for local folding induced by the urea fragment in short-chain oligomers","Organic & Biomolecular Chemistry","2008","6","14","2596","2610","10.1039/b801139g","","x-ray","0.7107","MoKα","","0.1033","0.0856","","","0.2327","0.2465","","","","","","1.087","","","","has coordinates,has disorder","180294","2020-10-21","18:00:00",""
"7150885","12.169","0.006","9.397","0.003","16.467","0.002","90","","103.86","0.03","90","","1828.2","1.1","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H29 N3 O3 -","- C14 H29 N3 O3 -","- C56 H116 N12 O12 -","4","1","","Fischer, Lucile; Didierjean, Claude; Jolibois, Franck; Semetey, Vincent; Manuel Lozano, Jose; Briand, Jean-Paul; Marraud, Michel; Poteau, Romuald; Guichard, Gilles","Propensity for local folding induced by the urea fragment in short-chain oligomers","Organic & Biomolecular Chemistry","2008","6","14","2596","2610","10.1039/b801139g","","x-ray","1.54184","CuKα","","0.0828","0.0656","","","0.1825","0.2002","","","","","","1.035","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150886","9.3903","0.0007","16.0688","0.001","19.4462","0.0018","90","","90","","90","","2934.3","0.4","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H40 N4 O6 -","- C26 H40 N4 O6 -","- C104 H160 N16 O24 -","4","1","","Fischer, Lucile; Didierjean, Claude; Jolibois, Franck; Semetey, Vincent; Manuel Lozano, Jose; Briand, Jean-Paul; Marraud, Michel; Poteau, Romuald; Guichard, Gilles","Propensity for local folding induced by the urea fragment in short-chain oligomers","Organic & Biomolecular Chemistry","2008","6","14","2596","2610","10.1039/b801139g","","x-ray","0.71073","MoKα","","0.0992","0.0441","","","0.0809","0.0993","","","","","","0.982","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150887","5.241","0.001","17.883","0.003","19.356","0.002","90","","90","","90","","1814.1","0.5","293","2","293","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H27 N3 O3 -","- C17 H27 N3 O3 -","- C68 H108 N12 O12 -","4","1","","Fischer, Lucile; Didierjean, Claude; Jolibois, Franck; Semetey, Vincent; Manuel Lozano, Jose; Briand, Jean-Paul; Marraud, Michel; Poteau, Romuald; Guichard, Gilles","Propensity for local folding induced by the urea fragment in short-chain oligomers","Organic & Biomolecular Chemistry","2008","6","14","2596","2610","","","x-ray","1.5406","","","0.0535","0.0503","","","0.1307","0.1377","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150888","4.675","0.002","9.497","0.002","10.809","0.003","76.78","0.02","81.59","0.03","77.55","0.02","453.8","0.3","293","2","293","2","","","","","","","synthesis as described","4","P 1","P 1","1","","","","- C19 H24 N4 O2 -","- C19 H24 N4 O2 -","- C19 H24 N4 O2 -","1","1","","Fischer, Lucile; Didierjean, Claude; Jolibois, Franck; Semetey, Vincent; Manuel Lozano, Jose; Briand, Jean-Paul; Marraud, Michel; Poteau, Romuald; Guichard, Gilles","Propensity for local folding induced by the urea fragment in short-chain oligomers","Organic & Biomolecular Chemistry","2008","6","14","2596","2610","10.1039/b801139g","","x-ray","1.5406","","","0.0714","0.0461","","","0.1039","0.1316","","","","","","1.144","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150889","10.712","0.006","11.368","0.004","15.945","0.004","90","","103.78","0.03","90","","1885.8","1.4","296.2","","296.2","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H25 N O2 S2 -","- C18 H25 N O2 S2 -","- C72 H100 N4 O8 S8 -","4","1","","Bradshaw, Benjamin; Evans, Paul; Fletcher, Jane; Lee, Alan T. L.; Mwashimba, Paul G.; Oehlrich, Daniel; Thomas, Eric J.; Davies, Robin H.; Allen, Benjamin C. P.; Broadley, Kenneth J.; Hamrouni, Amar; Escargueil, Christine","Synthesis of 5-hydroxy-2,3,4,5-tetrahydro-[1H]-2-benzazepin-4-ones: selective antagonists of muscarinic (M3) receptors","Organic & Biomolecular Chemistry","2008","6","12","2138","2157","10.1039/b801206g","","","1.5418","CuKα","","0.0677","0.0546","","","0.152","0.1688","","","","","","1.147","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150890","7.783","0.002","9.85","0.004","12.119","0.002","110.81","0.02","103.93","0.04","97.43","0.02","818.9","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H27 N O2 -","- C18 H27 N O2 -","- C36 H54 N2 O4 -","2","1","","Bradshaw, Benjamin; Evans, Paul; Fletcher, Jane; Lee, Alan T. L.; Mwashimba, Paul G.; Oehlrich, Daniel; Thomas, Eric J.; Davies, Robin H.; Allen, Benjamin C. P.; Broadley, Kenneth J.; Hamrouni, Amar; Escargueil, Christine","Synthesis of 5-hydroxy-2,3,4,5-tetrahydro-[1H]-2-benzazepin-4-ones: selective antagonists of muscarinic (M3) receptors","Organic & Biomolecular Chemistry","2008","6","12","2138","2157","10.1039/b801206g","","x-ray","0.71073","MoKα","","0.1167","0.0562","","","0.1095","0.1409","","","","","","1.049","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150891","24.883","0.002","15.352","0.002","17.848","0.002","90","","133.61","0.003","90","","4936.6","1","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C26 H26 Br N O5 S -","- C26 H26 Br N O5 S -","- C208 H208 Br8 N8 O40 S8 -","8","1","","Evans, Paul; Lee, Alan T. L.; Thomas, Eric J.","Synthesis of a 6-aryloxymethyl-5-hydroxy-2,3,4,5-tetrahydro-[1H]-2-benzazepin-4-one: a muscarinic (M3) antagonist","Organic & Biomolecular Chemistry","2008","6","12","2158","2167","10.1039/b801208c","","","0.71073","MoKα","","0.0566","0.0432","","","0.112","0.1203","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150892","10.0553","0.0019","13.715","0.002","15.384","0.003","64.024","0.007","80.245","0.012","70.714","0.01","1799.5","0.6","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C40 H49 Cl N6 O2 -","- C40 H49 Cl N6 O2 -","- C80 H98 Cl2 N12 O4 -","2","1","","Wang, Ting; Bai, Yu; Ma, Liang; Yan, Xiu-Ping","Synthesis and characterization of indolocarbazole-quinoxalines with flat rigid structure for sensing fluoride and acetate anions","Organic & Biomolecular Chemistry","2008","6","10","1751","1755","10.1039/b801447g","","","0.7107","MoKα","","0.0756","0.0609","","","0.16","0.1702","","","","","","1.057","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150893","12.077","0.002","13.878","0.003","14.279","0.003","108.73","0.03","107.18","0.03","95.52","0.03","2116.5","1","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C43 H54 Cl3 N6 O4.5 -","- C43 H54 Cl3 N6 O4.5 -","- C86 H108 Cl6 N12 O9 -","2","1","","Wang, Ting; Bai, Yu; Ma, Liang; Yan, Xiu-Ping","Synthesis and characterization of indolocarbazole-quinoxalines with flat rigid structure for sensing fluoride and acetate anions","Organic & Biomolecular Chemistry","2008","6","10","1751","1755","10.1039/b801447g","","","0.71073","MoKα","","0.0658","0.0537","","","0.1127","0.1181","","","","","","1.144","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7150894","13.1713","0.0003","7.0422","0.0001","14.1832","0.0003","90","","112.234","0.003","90","","1217.74","0.05","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H20 N2 O12 -","- C27 H20 N2 O12 -","- C54 H40 N4 O24 -","2","1","","Raffaelli, Barbara; Pohjoispää, Monika; Hase, Tapio; Cardin, Christine J.; Gan, Yu; Wähälä, Kristiina","Stereochemistry and rearrangement reactions of hydroxylignanolactones","Organic & Biomolecular Chemistry","2008","6","14","2619","2627","10.1039/b801593g","","","1.54184","Cukα","","0.0303","0.0292","","","0.0758","0.079","","","","","","1.037","","","","has coordinates","180294","2020-10-21","18:00:00",""
"7150895","6.429","0.001","13.631","0.002","50.896","0.006","90","","90","","90","","4460.2","1.1","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","(9alpha,13beta)-delta17,20-Protolanostane Alcohol","","","- C51 H84 O3 -","- C51 H80 O3 -","- C204 H320 O12 -","4","1","","Winne, Johan M.; De Clercq, Pierre J.; Milanesio, Marco; Pattison, Philip; Viterbo, Davide","Nonenzymic polycyclisation of analogues of oxidosqualene with a preformed C-ring","Organic & Biomolecular Chemistry","2008","6","11","1918","1925","10.1039/b801670d","","","0.7114","MoKα","","0.2217","0.2009","","","0.5235","0.5641","","","","","","1.057","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150896","9.624","0.0011","7.9566","0.0009","9.8099","0.0011","90","","118.093","0.001","90","","662.68","0.13","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H14 N2 O5 -","- C13 H14 N2 O5 -","- C26 H28 N4 O10 -","2","1","","Angelici, Gaetano; Contaldi, Simone; Lynn Green, Sarah; Tomasini, Claudia","Synthesis of imidazolidin-2-one-4-carboxylate and of (tetrahydro)pyrimidin-2-one-5-carboxylate via an efficient modification of the Hofmann rearrangement","Organic & Biomolecular Chemistry","2008","6","10","1849","1852","10.1039/b801909f","","","0.71073","MoKα","","0.0391","0.032","","","0.0799","0.0837","","","","","","1.234","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150897","6.8203","0.0008","5.5939","0.0007","20.585","0.003","90","","97.914","0.003","90","","777.88","0.18","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C14 H22 O9 -","- C14 H22 O9 -","- C28 H44 O18 -","2","1","","Nieto, Natalia; Munslow, Ian J.; Barr, Jonathan; Benet-Buchholz, J.; Vidal-Ferran, Anton","Dioxirane mediated asymmetric epoxidations: stereochemical studies via isotopic labeling","Organic & Biomolecular Chemistry","2008","6","13","2276","2281","10.1039/b801922c","","","0.71073","MoKα","","0.0939","0.05","","","0.1052","0.1244","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150898","6.566","0.0005","7.3847","0.0006","24.1727","0.0019","90","","90","","90","","1172.08","0.16","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H13 N O5 -","- C12 H13 N O5 -","- C48 H52 N4 O20 -","4","1","","Alcaide, Benito; Almendros, Pedro; Luna, Amparo; Torres, M. Rosario","Stereoselective NaN3-catalyzed halonitroaldol-type reaction of azetidine-2,3-diones in aqueous media","Organic & Biomolecular Chemistry","2008","6","9","1635","1640","10.1039/b802011f","","","0.71073","MoKα","","0.0579","0.0308","","","0.0636","0.0717","","","","","","0.972","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150899","11.0409","0.0011","6.1566","0.0006","12.5748","0.0013","90","","90.669","0.002","90","","854.71","0.15","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C16 H18 N2 O7 -","- C16 H18 N2 O7 -","- C32 H36 N4 O14 -","2","1","","Alcaide, Benito; Almendros, Pedro; Luna, Amparo; Torres, M. Rosario","Stereoselective NaN3-catalyzed halonitroaldol-type reaction of azetidine-2,3-diones in aqueous media","Organic & Biomolecular Chemistry","2008","6","9","1635","1640","10.1039/b802011f","","","0.71073","MoKα","","0.0919","0.041","","","0.0864","0.1024","","","","","","0.913","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150900","10.2053","0.0004","10.5866","0.0005","16.192","0.0008","72.052","0.002","80.971","0.002","62.274","0.004","1472.97","0.13","223","2","223","2","","","","","","","","6","P -1","-P 1","2","","","","- C30 H36 Cl N O Si2 -","- C30 H36 Cl N O Si2 -","- C60 H72 Cl2 N2 O2 Si4 -","2","1","","Karatas, Betül; Rendler, Sebastian; Fröhlich, Roland; Oestreich, Martin","Kinetic resolution of donor-functionalised tertiary alcohols by Cu‒H-catalysed stereoselective silylation using a strained silicon-stereogenic silane","Organic & Biomolecular Chemistry","2008","6","8","1435","1440","10.1039/b802186d","","","1.54178","CuKα","","0.0407","0.0384","","","0.1114","0.1136","","","","","","1.038","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150901","14.6545","0.0004","21.6938","0.0006","19.1708","0.0005","90","","101.885","0.001","90","","5964","0.3","223","2","223","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C31 H39 N O2 Si2 -","- C31 H39 N O2 Si2 -","- C248 H312 N8 O16 Si16 -","8","2","","Karatas, Betül; Rendler, Sebastian; Fröhlich, Roland; Oestreich, Martin","Kinetic resolution of donor-functionalised tertiary alcohols by Cu‒H-catalysed stereoselective silylation using a strained silicon-stereogenic silane","Organic & Biomolecular Chemistry","2008","6","8","1435","1440","10.1039/b802186d","","","1.54178","CuKα","","0.0762","0.0554","","","0.1256","0.1384","","","","","","1.038","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150902","10.2158","0.0003","10.5173","0.0003","16.3911","0.0005","72.213","0.002","81.203","0.002","61.845","0.003","1478.42","0.09","223","2","223","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H39 N O Si2 -","- C31 H39 N O Si2 -","- C62 H78 N2 O2 Si4 -","2","1","","Karatas, Betül; Rendler, Sebastian; Fröhlich, Roland; Oestreich, Martin","Kinetic resolution of donor-functionalised tertiary alcohols by Cu‒H-catalysed stereoselective silylation using a strained silicon-stereogenic silane","Organic & Biomolecular Chemistry","2008","6","8","1435","1440","10.1039/b802186d","","","1.54178","CuKα","","0.047","0.0426","","","0.1132","0.1172","","","","","","1.031","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150903","5.99","0.0003","15.612","0.0008","19.9389","0.001","90","","90","","90","","1864.6","0.16","223","2","223","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C18 H20 Cl N O Si -","- C18 H20 Cl N O Si -","- C72 H80 Cl4 N4 O4 Si4 -","4","1","","Karatas, Betül; Rendler, Sebastian; Fröhlich, Roland; Oestreich, Martin","Kinetic resolution of donor-functionalised tertiary alcohols by Cu‒H-catalysed stereoselective silylation using a strained silicon-stereogenic silane","Organic & Biomolecular Chemistry","2008","6","8","1435","1440","10.1039/b802186d","","","1.54178","CuKα","","0.046","0.0408","","","0.0956","0.0998","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150904","8.013","0.002","13.312","0.003","13.652","0.002","105.984","0.007","106.137","0.012","107.137","0.009","1231.4","0.5","9","","9","","","","","","","","","4","P -1","-P 1","2","substituted aziridine","","","- C12 H12 N2 O6 -","- C12 H12 N2 O6 -","- C48 H48 N8 O24 -","4","2","","Grabowsky, Simon; Pfeuffer, Thomas; Morgenroth, Wolfgang; Paulmann, Carsten; Schirmeister, Tanja; Luger, Peter","A comparative study on the experimentally derived electron densities of three protease inhibitor model compounds","Organic & Biomolecular Chemistry","2008","6","13","2295","2307","10.1039/b802831a","","","0.56","synchrotron","","0.0427","0.0271","","","","0.0241","","","","","","1.854","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150905","8.0274","0.0016","13.333","0.003","13.674","0.003","105.97","0.03","106.05","0.03","107.14","0.03","1238.5","0.7","27","2","27","2","","","","","","","","4","P -1","-P 1","2","acceptor-substituted aziridine","","","- C12 H12 N2 O6 -","- C12 H12 N2 O6 -","- C48 H48 N8 O24 -","4","2","","Grabowsky, Simon; Pfeuffer, Thomas; Morgenroth, Wolfgang; Paulmann, Carsten; Schirmeister, Tanja; Luger, Peter","A comparative study on the experimentally derived electron densities of three protease inhibitor model compounds","Organic & Biomolecular Chemistry","2008","6","13","2295","2307","10.1039/b802831a","","","0.71073","MoKα","","0.052","0.033","","","","0.039","0.045","","","","","1.426","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150906","7.746","0.001","8.08","0.001","11.835","0.001","86.198","0.001","74.105","0.001","60.673","0.001","619.07","0.12","100","","100","","","","","","","","","4","P -1","-P 1","2","acceptor-substituted oxirane","","","- C12 H11 N O7 -","- C12 H11 N O7 -","- C24 H22 N2 O14 -","2","1","","Grabowsky, Simon; Pfeuffer, Thomas; Morgenroth, Wolfgang; Paulmann, Carsten; Schirmeister, Tanja; Luger, Peter","A comparative study on the experimentally derived electron densities of three protease inhibitor model compounds","Organic & Biomolecular Chemistry","2008","6","13","2295","2307","10.1039/b802831a","","","0.56","synchrotron","","0.058","0.032","","","","0.044","0.048","","","","","0.996","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150907","7.769","0.002","7.865","0.001","10.811","0.001","87.61","0.02","85.41","0.04","62.43","0.01","583.69","0.19","9","","9","","","","","","","","","4","P -1","-P 1","2","acceptor-substituted olefin","","","- C12 H11 N O6 -","- C12 H11 N O6 -","- C24 H22 N2 O12 -","2","1","","Grabowsky, Simon; Pfeuffer, Thomas; Morgenroth, Wolfgang; Paulmann, Carsten; Schirmeister, Tanja; Luger, Peter","A comparative study on the experimentally derived electron densities of three protease inhibitor model compounds","Organic & Biomolecular Chemistry","2008","6","13","2295","2307","10.1039/b802831a","","","0.5166","synchrotron","","0.034","0.027","","","","0.033","0.049","","","","","1.468","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150908","13.6246","0.0003","7.0143","0.0001","7.8922","0.0002","90","","99.789","0.002","90","","743.25","0.03","150","","150","","","","","","","","","3","C 1 2/m 1","-C 2y","12","6-cyclopropyl-9H-purine","6-cyclopropyl-9H-purine","","- C8 H8 N4 -","- C8 H8 N4 -","- C32 H32 N16 -","4","0.5","","Kuchař, Martin; Pohl, Radek; Klepetářová, Blanka; Votruba, Ivan; Hocek, Michal","Synthesis of substituted 6-cyclopropylpurine bases and nucleosides by cross-coupling reactions or cyclopropanations","Organic & Biomolecular Chemistry","2008","6","13","2377","2387","10.1039/b802833h","","x-ray","1.54184","CuKα","","0.0446","0.0409","","0.0588","0.0577","0.0577","","","","","","0.944","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150909","22.2791","0.0002","16.203","0.0001","4.98","","90","","90","","90","","1797.72","0.02","150","","150","","","","","","","","","4","P n a 21","P 2c -2n","33","9-Benzyl-6-(2-(diethylcarbamoyl)cyclopropyl)purine","9-Benzyl-6-[2-(diethylcarbamoyl)cyclopropyl]purine","","- C20 H23 N5 O -","- C20 H23 N5 O -","- C80 H92 N20 O4 -","4","1","","Kuchař, Martin; Pohl, Radek; Klepetářová, Blanka; Votruba, Ivan; Hocek, Michal","Synthesis of substituted 6-cyclopropylpurine bases and nucleosides by cross-coupling reactions or cyclopropanations","Organic & Biomolecular Chemistry","2008","6","13","2377","2387","10.1039/b802833h","","x-ray","1.54184","CuKα","","0.0361","0.0296","","0.0402","0.0328","0.0328","","","","","","1.0836","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150910","8.6787","0.0009","13.9781","0.0015","12.3242","0.0013","90","","99.664","0.002","90","","1473.9","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 N O2 S -","- C16 H17 N O2 S -","- C64 H68 N4 O8 S4 -","4","1","","Fan, Li-Yan; Gao, Fei-Feng; Jiang, Wei-Hua; Deng, Min-Zhi; Qian, Chang-Tao","A simple, efficient Pd-catalyzed synthesis of N-sulfonylimines from organoboronic acids and tosylbenzimidoyl chlorides","Organic & Biomolecular Chemistry","2008","6","12","2133","2137","10.1039/b802867b","","","0.71073","MoKα","","0.0617","0.0498","","","0.1359","0.1425","","","","","","0.97","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150911","3.7926","0.0008","20.217","0.004","12.385","0.003","90","","94.91","0.01","90","","946.1","0.4","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","2,5-bis(buta-1,3-diynyl)-pyridine","2,5-bis(buta-1,3-diynyl)-pyridine","","- C13 H5 N -","- C13 H5 N -","- C52 H20 N4 -","4","1","","West, Kara; Wang, Changsheng; Batsanov, Andrei S.; Bryce, Martin R.","Carbon-rich molecules: synthesis and isolation of aryl/heteroaryl terminal bis(butadiynes) (HCC‒CC‒Ar‒CC‒CCH) and their applications in the synthesis of oligo(arylenebutadiynylene) molecular wires","Organic & Biomolecular Chemistry","2008","6","11","1934","1937","10.1039/b802968g","","","0.71073","MoKα","","0.1796","0.0686","","","0.1609","0.208","","","","","","0.865","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150912","17.555","0.002","9.126","0.001","19.831","0.002","90","","101.46","0.01","90","","3113.7","0.6","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","6-(4-buta-1,3-diynyl-2,5-dimethoxyphenyl)-2-methylhexa-3,5- diyn-2-ol","6-(4-buta-1,3-diynyl-2,5-dimethoxyphenyl)-2-methylhexa- 3,5-diyn-2-ol","","- C19 H16 O3 -","- C19 H16 O3 -","- C152 H128 O24 -","8","1","","West, Kara; Wang, Changsheng; Batsanov, Andrei S.; Bryce, Martin R.","Carbon-rich molecules: synthesis and isolation of aryl/heteroaryl terminal bis(butadiynes) (HCC‒CC‒Ar‒CC‒CCH) and their applications in the synthesis of oligo(arylenebutadiynylene) molecular wires","Organic & Biomolecular Chemistry","2008","6","11","1934","1937","10.1039/b802968g","","","0.71073","MoKα","","0.1036","0.0444","","","0.0795","0.0945","","","","","","0.903","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150913","5.7609","0.0007","9.0756","0.001","12.6163","0.0014","87.79","0.01","77.87","0.01","77.99","0.01","630.77","0.13","120","2","120","2","","","","","","","","4","P -1","-P 1","2","6-(6-buta-1,3-diynyl-pyridin-3-yl)-2-methyl-hexa-3,5-diyn-2-ol","6-(6-buta-1,3-diynyl-pyridin-3-yl)-2-methyl-hexa-3,5-diyn-2-ol","","- C16 H11 N O -","- C16 H11 N O -","- C32 H22 N2 O2 -","2","1","","West, Kara; Wang, Changsheng; Batsanov, Andrei S.; Bryce, Martin R.","Carbon-rich molecules: synthesis and isolation of aryl/heteroaryl terminal bis(butadiynes) (HCC‒CC‒Ar‒CC‒CCH) and their applications in the synthesis of oligo(arylenebutadiynylene) molecular wires","Organic & Biomolecular Chemistry","2008","6","11","1934","1937","10.1039/b802968g","","","0.71073","MoKα","","0.0632","0.0436","","","0.1068","0.1171","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150914","11.778","0.002","16.333","0.003","21.185","0.005","90","","90","","90","","4075.4","1.4","150","","150","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H27 N3 O3 S -","- C20 H27 N3 O3 S -","- C160 H216 N24 O24 S8 -","8","1","","Berini, Christophe; Minassian, Frédéric; Pelloux-Léon, Nadia; Denis, Jean-Noël; Vallée, Yannick; Philouze, Christian","Efficient stereoselective nucleophilic addition of pyrroles to chiral nitrones","Organic & Biomolecular Chemistry","2008","6","14","2574","2586","10.1039/b802997k","","","0.71073","MoKα","","0.0506","0.0506","","0.0603","","0.0603","","","1.032","","","1.032","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7150915","9.198","0.002","9.198","0.002","40.598","0.008","90","","90","","90","","3434.7","1.3","293","","293","","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","","","","- C17 H22 N2 O3 -","- C17 H22 N2 O3 -","- C136 H176 N16 O24 -","8","1","","Berini, Christophe; Minassian, Frédéric; Pelloux-Léon, Nadia; Denis, Jean-Noël; Vallée, Yannick; Philouze, Christian","Efficient stereoselective nucleophilic addition of pyrroles to chiral nitrones","Organic & Biomolecular Chemistry","2008","6","14","2574","2586","10.1039/b802997k","","","1.54178","CuKα","","0.0454","0.0454","","0.0484","","0.0484","","","1.565","","","1.565","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150916","11.014","0.001","13.24","0.002","17.939","0.002","90","","90","","90","","2616","0.5","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H14 N2 O3 -","- C14 H14 N2 O3 -","- C112 H112 N16 O24 -","8","2","","Berini, Christophe; Minassian, Frédéric; Pelloux-Léon, Nadia; Denis, Jean-Noël; Vallée, Yannick; Philouze, Christian","Efficient stereoselective nucleophilic addition of pyrroles to chiral nitrones","Organic & Biomolecular Chemistry","2008","6","14","2574","2586","10.1039/b802997k","","","0.71073","MoKα","","0.048","0.048","","0.0734","","0.0734","","","0.739","","","0.739","","","","has coordinates","193981","2020-10-21","18:00:00",""
"7150917","5.96","0.001","12.835","0.002","16.626","0.001","90","","90","","90","","1271.8","0.3","293","","293","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H14 N2 O3 -","- C14 H14 N2 O3 -","- C56 H56 N8 O12 -","4","1","","Berini, Christophe; Minassian, Frédéric; Pelloux-Léon, Nadia; Denis, Jean-Noël; Vallée, Yannick; Philouze, Christian","Efficient stereoselective nucleophilic addition of pyrroles to chiral nitrones","Organic & Biomolecular Chemistry","2008","6","14","2574","2586","10.1039/b802997k","","","0.71073","MoKα","","0.049","0.049","","0.062","","0.062","","","1.512","","","1.512","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150918","9.819","0.003","11.498","0.003","11.946","0.003","68.553","0.004","69.635","0.004","69.955","0.004","1140.4","0.5","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H24 N2 -","- C32 H24 N2 -","- C64 H48 N4 -","2","1","","Nair, Vijay; Nandialath, Vidya; Abhilash, Keecherikunnel G.; Suresh, Eringathodi","An efficient synthesis of indolo[3,2-a]carbazoles via the novel acid catalyzed reaction of indoles and diaryl-1,2-diones","Organic & Biomolecular Chemistry","2008","6","10","1738","1742","10.1039/b803009j","","","0.71073","MoKα","","0.0761","0.0591","","","0.1389","0.1482","","","","","","1.053","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150919","8.2446","0.001","14.3609","0.0017","15.8071","0.0019","111.22","0.002","95.001","0.002","105.513","0.002","1645.5","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C41 H40 Cl2 N2 O -","- C41 H40 Cl2 N2 O -","- C82 H80 Cl4 N4 O2 -","2","1","","Nair, Vijay; Nandialath, Vidya; Abhilash, Keecherikunnel G.; Suresh, Eringathodi","An efficient synthesis of indolo[3,2-a]carbazoles via the novel acid catalyzed reaction of indoles and diaryl-1,2-diones","Organic & Biomolecular Chemistry","2008","6","10","1738","1742","10.1039/b803009j","","","0.71073","MoKα","","0.1344","0.1089","","","0.2814","0.2994","","","","","","1.091","","","","has coordinates","288193","2023-12-08","17:12:24",""
"7150920","9.4794","0.0005","12.6941","0.0006","16.9496","0.0009","102.548","0.001","102.983","0.001","90.422","0.001","1936.59","0.17","173","2","173","2","","","","","","","","4","P -1","-P 1","2","11-Hydroxy-4-isopropyl-8,13-diaza- tricyclo(7.3.1.0$2,7!)trideca-2(7),3,5,10-tetraene-8,10,13- tricarboxylic acid trimethyl ester","11-Hydroxy-4-isopropyl-8,13-diaza-tricyclo[7.3.1.0^2,7^]trideca- 2(7),3,5,10-tetraene-8,10,13-tricarboxylic acid trimethyl ester","","- C20 H24 N2 O7 -","- C20 H24 N2 O7 -","- C80 H96 N8 O28 -","4","2","","Karapetyan, Vahuni; Mkrtchyan, Satenik; Schmidt, Andreas; Gütlein, Jörg-Peter; Villinger, Alexander; Reinke, Helmut; Jiao, Haijun; Fischer, Christine; Langer, Peter","Synthesis of 3,4-benzo-7-hydroxy-2,9-diazabicyclo[3.3.1]non-7-enes by cyclization of 1,3-bis(silyl enol ethers) with quinazolines","Organic & Biomolecular Chemistry","2008","6","16","2961","2968","10.1039/b803141j","","","0.71073","MoKα","","0.0806","0.0494","","","0.1163","0.1334","","","","","","1.027","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150921","8.4449","0.0001","9.443","0.0002","13.2714","0.0002","95.001","0.001","100.061","0.001","99.238","0.001","1021.29","0.03","173","2","173","2","","","","","","","","4","P -1","-P 1","2","4-tert-Butyl-11-hydroxy-8,13-diaza- tricyclo(7.3.1.0$2,7!)trideca-2(7),3,5,10-tetraene-8,10,13- tricarboxylic acid trimetyl ester","4-tert-Butyl-11-hydroxy-8,13-diaza-tricyclo[7.3.1.0^2,7^]trideca-2(7),3,5,10- tetraene-8,10,13-tricarboxylic acid trimetyl ester","","- C21 H26 N2 O7 -","- C21 H26 N2 O7 -","- C42 H52 N4 O14 -","2","1","","Karapetyan, Vahuni; Mkrtchyan, Satenik; Schmidt, Andreas; Gütlein, Jörg-Peter; Villinger, Alexander; Reinke, Helmut; Jiao, Haijun; Fischer, Christine; Langer, Peter","Synthesis of 3,4-benzo-7-hydroxy-2,9-diazabicyclo[3.3.1]non-7-enes by cyclization of 1,3-bis(silyl enol ethers) with quinazolines","Organic & Biomolecular Chemistry","2008","6","16","2961","2968","10.1039/b803141j","","","0.71073","MoKα","","0.0634","0.0491","","","0.1301","0.1456","","","","","","1.035","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150922","8.2926","0.0002","8.4322","0.0002","13.9059","0.0003","91.236","0.001","98.845","0.001","95.885","0.001","955.05","0.04","173","2","173","2","","","","","","","","4","P -1","-P 1","2","11-Hydroxy-4,5(1',3')-propylene-8,13-diaza- tricyclo(7.3.1.0$2,7!)trideca-2(7),3,5,10-tetraene-8,10,13- tricarboxylic acid trimethyl ester","11-Hydroxy-4,5(1',3')-propylene-8,13-diaza- tricyclo[7.3.1.0^2,7^]trideca-2(7),3,5,10-tetraene-8,10,13- tricarboxylic acid trimethyl ester","","- C20 H22 N2 O7 -","- C20 H22 N2 O7 -","- C40 H44 N4 O14 -","2","1","","Karapetyan, Vahuni; Mkrtchyan, Satenik; Schmidt, Andreas; Gütlein, Jörg-Peter; Villinger, Alexander; Reinke, Helmut; Jiao, Haijun; Fischer, Christine; Langer, Peter","Synthesis of 3,4-benzo-7-hydroxy-2,9-diazabicyclo[3.3.1]non-7-enes by cyclization of 1,3-bis(silyl enol ethers) with quinazolines","Organic & Biomolecular Chemistry","2008","6","16","2961","2968","10.1039/b803141j","","","0.71073","MoKα","","0.0579","0.0522","","","0.1486","0.1569","","","","","","1.053","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150923","8.1758","0.0016","8.9304","0.0018","13.714","0.003","103.88","0.03","96.73","0.03","105.83","0.03","917.1","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","11-Hydroxy-4,5-dimethyl-8,13-diaza- tricyclo(7.3.1.02,7)trideca-2(7),3,5,10-tetraene-8,13-tricarboxylic acid trimethyl ester","11-Hydroxy-4,5-dimethyl-8,13-diaza-tricyclo[7.3.1.02,7]trideca-2(7),3,5,10- tetraene-8,13-tricarboxylic acid trimethyl ester","","- C19 H22 N2 O7 -","- C19 H22 N2 O7 -","- C38 H44 N4 O14 -","2","1","","Karapetyan, Vahuni; Mkrtchyan, Satenik; Schmidt, Andreas; Gütlein, Jörg-Peter; Villinger, Alexander; Reinke, Helmut; Jiao, Haijun; Fischer, Christine; Langer, Peter","Synthesis of 3,4-benzo-7-hydroxy-2,9-diazabicyclo[3.3.1]non-7-enes by cyclization of 1,3-bis(silyl enol ethers) with quinazolines","Organic & Biomolecular Chemistry","2008","6","16","2961","2968","10.1039/b803141j","","","0.71073","MoKα","","0.0542","0.0463","","","0.1068","0.1098","","","","","","1.055","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150924","7.4315","0.0016","8.443","0.0018","21.576","0.005","90","","90","","90","","1353.8","0.5","93","2","93","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 N2 O3 -","- C15 H18 N2 O3 -","- C60 H72 N8 O12 -","4","1","","Zezula, Josef; Singer, Lisa; Przybył, Anna K.; Hashimoto, Akihiro; Dersch, Christina M.; Rothman, Richard B.; Deschamps, Jeffrey; Lee, Yong Sok; Jacobson, Arthur E.; Rice, Kenner C.","Synthesis and pharmacological effects of the enantiomers of the N-phenethyl analogues of the ortho and para e- and f-oxide-bridged phenylmorphans","Organic & Biomolecular Chemistry","2008","6","16","2868","2883","10.1039/b803433h","","","0.71073","MoKα","","0.0459","0.0419","","","0.1064","0.1085","","","","","","1.094","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150925","8.7028","0.0011","13.9149","0.0015","30.493","0.003","90","","90","","90","","3692.7","0.7","93","2","93","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36.5 H43 F N2 O12.5 -","- C36.5 H43 F N2 O12.5 -","- C146 H172 F4 N8 O50 -","4","1","","Zezula, Josef; Singer, Lisa; Przybył, Anna K.; Hashimoto, Akihiro; Dersch, Christina M.; Rothman, Richard B.; Deschamps, Jeffrey; Lee, Yong Sok; Jacobson, Arthur E.; Rice, Kenner C.","Synthesis and pharmacological effects of the enantiomers of the N-phenethyl analogues of the ortho and para e- and f-oxide-bridged phenylmorphans","Organic & Biomolecular Chemistry","2008","6","16","2868","2883","10.1039/b803433h","","","0.71073","MoKα","","0.0747","0.0621","","","0.127","0.1312","","","","","","1.122","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150926","7.719","0.003","13.922","0.005","24.899","0.012","90","","90","","90","","2675.7","1.9","93","2","93","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C25 H33 Br N2 O7 S -","- C25 H33 Br N2 O7 S -","- C100 H132 Br4 N8 O28 S4 -","4","1","","Zezula, Josef; Singer, Lisa; Przybył, Anna K.; Hashimoto, Akihiro; Dersch, Christina M.; Rothman, Richard B.; Deschamps, Jeffrey; Lee, Yong Sok; Jacobson, Arthur E.; Rice, Kenner C.","Synthesis and pharmacological effects of the enantiomers of the N-phenethyl analogues of the ortho and para e- and f-oxide-bridged phenylmorphans","Organic & Biomolecular Chemistry","2008","6","16","2868","2883","10.1039/b803433h","","","0.71073","MoKα","","0.0508","0.0394","","","0.1069","0.1159","","","","","","0.939","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150927","7.5366","0.0002","11.9922","0.0004","21.9804","0.0011","90","","90","","90","","1986.6","0.13","298","2","298","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H26 Br N O2 -","- C22 H26 Br N O2 -","- C88 H104 Br4 N4 O8 -","4","1","","Zezula, Josef; Singer, Lisa; Przybył, Anna K.; Hashimoto, Akihiro; Dersch, Christina M.; Rothman, Richard B.; Deschamps, Jeffrey; Lee, Yong Sok; Jacobson, Arthur E.; Rice, Kenner C.","Synthesis and pharmacological effects of the enantiomers of the N-phenethyl analogues of the ortho and para e- and f-oxide-bridged phenylmorphans","Organic & Biomolecular Chemistry","2008","6","16","2868","2883","10.1039/b803433h","","","0.71073","MoKα","","0.0436","0.0329","","","0.075","0.0787","","","","","","1.029","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150928","13.851","0.003","4.8284","0.001","35.183","0.007","90","","90","","90","","2353","0.8","173","2","173","2","","","","","","","","4","P n a 21","P 2c -2n","33","Methyl 4-(fur-2-yl)-6-trifluormethyl-salicylate","Methyl 4-(fur-2-yl)-6-trifluormethyl-salicylate","","- C13 H9 F3 O4 -","- C13 H9 F3 O4 -","- C104 H72 F24 O32 -","8","2","","Hussain, Ibrar; Riahi, Abdolmajid; Yawer, Mirza Arfan; Villinger, Alexander; Fischer, Christine; Görls, Helmar; Langer, Peter","One-pot synthesis of 6-(thien-2-yl)- and 6-(fur-2-yl)salicylates based on regioselective [3 + 3] cyclocondensations of 1,3-bis(trimethylsilyloxy)-1,3-butadienes","Organic & Biomolecular Chemistry","2008","6","19","3542","3551","10.1039/b803472a","","","0.71073","MoKα","","0.1026","0.0711","","","0.1693","0.1907","","","","","","1.032","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150929","13.84","0.003","4.931","0.001","35.86","0.007","90","","90","","90","","2447.3","0.9","173","2","173","2","","","","","","","","5","P n a 21","P 2c -2n","33","Methyl 4-(thien-2-yl)-6-trifluormethyl-salicylate","Methyl 4-(thien-2-yl)-6-trifluormethyl-salicylate","","- C13 H9 F3 O3 S -","- C13 H9 F3 O3 S -","- C104 H72 F24 O24 S8 -","8","2","","Hussain, Ibrar; Riahi, Abdolmajid; Yawer, Mirza Arfan; Villinger, Alexander; Fischer, Christine; Görls, Helmar; Langer, Peter","One-pot synthesis of 6-(thien-2-yl)- and 6-(fur-2-yl)salicylates based on regioselective [3 + 3] cyclocondensations of 1,3-bis(trimethylsilyloxy)-1,3-butadienes","Organic & Biomolecular Chemistry","2008","6","19","3542","3551","10.1039/b803472a","","","0.71073","MoKα","","0.063","0.0526","","","0.1134","0.1202","","","","","","1.107","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150930","7.0866","0.0005","9.2066","0.0007","10.2121","0.0009","95.843","0.004","105.477","0.005","98.661","0.005","627.7","0.09","183","2","183","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H14 O3 S -","- C14 H14 O3 S -","- C28 H28 O6 S2 -","2","1","","Hussain, Ibrar; Riahi, Abdolmajid; Yawer, Mirza Arfan; Villinger, Alexander; Fischer, Christine; Görls, Helmar; Langer, Peter","One-pot synthesis of 6-(thien-2-yl)- and 6-(fur-2-yl)salicylates based on regioselective [3 + 3] cyclocondensations of 1,3-bis(trimethylsilyloxy)-1,3-butadienes","Organic & Biomolecular Chemistry","2008","6","19","3542","3551","10.1039/b803472a","","","0.71073","MoKα","","0.1367","0.0757","","","0.1982","0.2341","","","","","","1.031","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150931","11.6696","0.0003","13.9357","0.0003","17.5533","0.0003","101.922","0.0013","98.0811","0.0013","95.1456","0.001","2744.43","0.11","160","1","160","1","","","","","","","","4","P -1","-P 1","2","","","","- C35 H31 N3 O2 -","- C35 H31 N3 O2 -","- C140 H124 N12 O8 -","4","2","","Klosterman, Jeremy K.; Linden, Anthony; Siegel, Jay S.","Synthesis of aryl-substituted 2-pyridyl-1,10-phenanthrolines; a series of oriented terpyridine analogues","Organic & Biomolecular Chemistry","2008","6","15","2755","2764","10.1039/b804106g","","","0.71073","MoKα","","0.0932","0.0551","","","0.1272","0.1498","","","","","","1.051","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150932","12.2155","0.0003","14.8014","0.0004","15.6657","0.0004","90","","90","","90","","2832.46","0.13","160","1","160","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C35 H31 N3 O2 -","- C35 H31 N3 O2 -","- C140 H124 N12 O8 -","4","1","","Klosterman, Jeremy K.; Linden, Anthony; Siegel, Jay S.","Synthesis of aryl-substituted 2-pyridyl-1,10-phenanthrolines; a series of oriented terpyridine analogues","Organic & Biomolecular Chemistry","2008","6","15","2755","2764","10.1039/b804106g","","","0.71073","MoKα","","0.0714","0.0456","","","0.1041","0.1193","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150933","5.1502","0.0003","11.2491","0.0009","26.05","0.002","90","","90.408","0.005","90","","1509.17","0.19","183","2","183","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H19 N O4 -","- C16 H19 N O4 -","- C64 H76 N4 O16 -","4","1","","Schmidt, Andreas; Michalik, Dirk; Rotzoll, Sven; Ullah, Ehsan; Fischer, Christine; Reinke, Helmut; Görls, Helmar; Langer, Peter","Synthesis of azoxabicyclo[3.3.1]nonanones based on diastereoselective reactions of 1,1-bis(trimethylsilyloxy)ketene acetals with isoquinolines and quinolines","Organic & Biomolecular Chemistry","2008","6","15","2804","2814","10.1039/b804139c","","","0.71073","MoKα","","0.121","0.0598","","","0.1252","0.1518","","","","","","1.024","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7150934","10.8722","0.001","5.6676","0.0005","12.916","0.0012","90","","106.839","0.001","90","","761.75","0.12","273","2","273","2","","","","","","","","4","P 1 21 1","P 2yb","4","diols","","","- C16 H23 N O4 -","- C16 H23 N O4 -","- C32 H46 N2 O8 -","2","1","","Pandey, Ganesh; Bharadwaj, Kishor Chandra; Khan, M. Islam; Shashidhara, K. S.; Puranik, Vedavati G.","Synthesis of polyhydroxy piperidines and their analogues: a novel approach towards selective inhibitors of α-glucosidase","Organic & Biomolecular Chemistry","2008","6","14","2587","2595","10.1039/b804278k","","","0.71073","MoKα","","0.0532","0.0482","","","0.1185","0.1252","","","","","","1.143","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150935","10.9255","0.0006","5.6715","0.0003","12.9037","0.0008","90","","107.143","0.001","90","","764.04","0.08","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","diols","","","- C16 H23 N O4 -","- C16 H23 N O4 -","- C32 H46 N2 O8 -","2","1","","Pandey, Ganesh; Bharadwaj, Kishor Chandra; Khan, M. Islam; Shashidhara, K. S.; Puranik, Vedavati G.","Synthesis of polyhydroxy piperidines and their analogues: a novel approach towards selective inhibitors of α-glucosidase","Organic & Biomolecular Chemistry","2008","6","14","2587","2595","10.1039/b804278k","","","0.71073","MoKα","","0.0607","0.0565","","","0.1142","0.1156","","","","","","1.175","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150936","8.8918","0.0003","15.1623","0.0007","13.7021","0.0005","90","","97.145","0.003","90","","1832.97","0.12","120","","120","","","","","","","","?","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H24 O2 Si -","- C20 H24 O2 Si -","- C80 H96 O8 Si4 -","4","1","","Robertson, Jeremy; Green, Stuart P.; Hall, Michael J.; Tyrrell, Andrew J.; Unsworth, William P.","Further studies on silatropic carbonyl ene cyclisations: β-crotyl(diphenyl)silyloxy aldehyde substrates; synthesis of 2-deoxy-2-C-phenylhexoses","Organic & Biomolecular Chemistry","2008","6","14","2628","2635","10.1039/b804752a","","","0.71073","MoKα","","","0.0515","","","","0.0584","","","","","","1.0328","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150937","11.989","0.002","10.7196","0.001","13.1319","0.001","90","","98.847","0.009","90","","1667.6","0.3","295","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H13 N3 O4 -","- C19 H13 N3 O4 -","- C76 H52 N12 O16 -","4","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","","0.71069","MoKα","","0.2292","0.0509","","","0.1232","0.1403","","","","","","0.628","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150938","7.5107","0.0005","10.4161","0.0008","10.9534","0.0007","111.597","0.003","96.849","0.003","103.339","0.003","755.26","0.09","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C15 H13 Cl N2 O4 -","- C15 H13 Cl N2 O4 -","- C30 H26 Cl2 N4 O8 -","2","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.0557","0.0493","","","0.1162","0.1196","","","","","","1.146","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150939","9.1376","0.0006","9.8479","0.0006","17.8528","0.0013","90","","98.305","0.004","90","","1589.66","0.18","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H13 N3 O3 -","- C19 H13 N3 O3 -","- C76 H52 N12 O12 -","4","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.0575","0.0443","","","0.11","0.1178","","","","","","1.061","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150940","9.1044","0.0008","9.8097","0.0008","10.3197","0.0009","76.326","0.005","69.235","0.004","87.179","0.004","836.76","0.13","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C19 H12 Cl N3 O3 -","- C19 H12 Cl N3 O3 -","- C38 H24 Cl2 N6 O6 -","2","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.0496","0.0415","","","0.1141","0.1203","","","","","","1.054","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150941","21.887","0.002","6.6306","0.0008","23.23","0.002","90","","90.527","0.005","90","","3371.1","0.6","100","2","100","2","","","","","","","synthesis as described","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H12 Cl N3 O3 -","- C19 H12 Cl N3 O3 -","- C152 H96 Cl8 N24 O24 -","8","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.0539","0.0451","","","0.1118","0.1181","","","","","","1.035","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150942","9.0017","0.0012","9.2015","0.0012","11.8723","0.0016","84.823","0.007","69.598","0.007","70.128","0.006","866.4","0.2","100","2","100","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C20 H15 N3 O4 -","- C20 H15 N3 O4 -","- C40 H30 N6 O8 -","2","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.0632","0.0519","","","0.13","0.1371","","","","","","1.046","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150943","7.4444","0.0005","8.6287","0.0006","12.8065","0.0008","71.202","0.003","87.399","0.003","83.872","0.003","774.25","0.09","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C18 H10 Cl N3 O3 -","- C18 H10 Cl N3 O3 -","- C36 H20 Cl2 N6 O6 -","2","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.041","0.038","","","0.0917","0.0936","","","","","","1.053","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150944","7.2738","0.0008","9.1406","0.0009","12.8097","0.0014","72.904","0.004","87.391","0.004","83.669","0.004","809","0.15","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C18 H9 Cl2 N3 O3 -","- C18 H9 Cl2 N3 O3 -","- C36 H18 Cl4 N6 O6 -","2","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.0333","0.0282","","","0.0691","0.0727","","","","","","1.03","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150945","13.2556","0.0006","6.9193","0.0003","22.4721","0.001","90","","95.608","0.002","90","","2051.26","0.16","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C21 H15 Cl2 N3 O4 -","- C21 H15 Cl2 N3 O4 -","- C84 H60 Cl8 N12 O16 -","4","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.036","0.0349","","","0.0784","0.0791","","","","","","1.128","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150946","11.4743","0.0011","10.6042","0.0012","13.097","0.0014","90","","98.668","0.005","90","","1575.4","0.3","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H10 Cl N3 O3 -","- C18 H10 Cl N3 O3 -","- C72 H40 Cl4 N12 O12 -","4","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.0408","0.0371","","","0.0873","0.0895","","","","","","1.057","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150947","8.5421","0.0006","26.3062","0.0018","8.6602","0.0006","90","","111.132","0.003","90","","1815.2","0.2","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/a 1","-P 2yab","14","","","","- C20 H15 Cl N2 O4 -","- C20 H15 Cl N2 O4 -","- C80 H60 Cl4 N8 O16 -","4","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.0496","0.0394","","","0.0916","0.0967","","","","","","1.046","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150948","7.1149","0.0011","18.63","0.003","13.388","0.002","90","","98.387","0.006","90","","1755.6","0.5","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H12 Cl N3 O4 -","- C19 H12 Cl N3 O4 -","- C76 H48 Cl4 N12 O16 -","4","1","","Bentabed-Ababsa, Ghenia; Derdour, Aicha; Roisnel, Thierry; Sáez, Jose A.; Domingo, Luis R.; Mongin, Florence","Polar [3 + 2] cycloaddition of ketones with electrophilically activated carbonyl ylides. Synthesis of spirocyclic dioxolane indolinones","Organic & Biomolecular Chemistry","2008","6","17","3144","3157","10.1039/b804856h","","x-ray","0.71073","MoKα","","0.0887","0.0682","","","0.1876","0.2032","","","","","","1.052","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150949","14.127","0.001","11.91","0.002","7.618","0.002","90","","90","","90","","1281.7","0.4","198","2","198","2","","","","","","","synthesis","4","P n a 21","P 2c -2n","33","","","","- C15 H13 N O3 -","- C15 H13 N O3 -","- C60 H52 N4 O12 -","4","1","","Forke, Ronny; Jäger, Anne; Knölker, Hans-Joachim","First total synthesis of clausine L and pityriazole, a metabolite of the human pathogenic yeast Malassezia furfur","Organic & Biomolecular Chemistry","2008","6","14","2481","2483","10.1039/b805451g","","x-ray","0.71073","MoKα","","0.0829","0.0464","","","0.094","0.1111","","","","","","1.067","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150950","12.061","0.001","22.545","0.001","9.161","0.001","90","","107.45","0.01","90","","2376.4","0.4","293","2","293","2","","","","","","","synthesis","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H20 N2 O5 S -","- C28 H20 N2 O5 S -","- C112 H80 N8 O20 S4 -","4","1","","Forke, Ronny; Jäger, Anne; Knölker, Hans-Joachim","First total synthesis of clausine L and pityriazole, a metabolite of the human pathogenic yeast Malassezia furfur","Organic & Biomolecular Chemistry","2008","6","14","2481","2483","10.1039/b805451g","","x-ray","0.71073","MoKα","","0.1021","0.0524","","","0.1031","0.1213","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150951","13.312","0.003","8.618","0.0017","19.427","0.004","90","","103.393","0.005","90","","2168.1","0.8","93","2","93","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C28 H21 N O3 -","- C28 H21 N O3 -","- C112 H84 N4 O12 -","4","1","","Joannesse, Caroline; Simal, Carmen; Concellón, Carmen; Thomson, Jennifer E.; Campbell, Craig D.; Slawin, Alexandra M. Z.; Smith, Andrew D.","Amidine catalysed O- to C-carboxyl transfer of heterocyclic carbonate derivatives","Organic & Biomolecular Chemistry","2008","6","16","2900","2907","10.1039/b805850d","","","0.71073","MoKα","","0.0909","0.0585","","","0.1332","0.1537","","","","","","1.056","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150952","6.6493","0.0013","10.852","0.002","14.037","0.003","87.214","0.003","85.458","0.003","75.19","0.003","975.7","0.3","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H22 N2 O4 S -","- C22 H22 N2 O4 S -","- C44 H44 N4 O8 S2 -","2","1","","Price Mortimer, Anne J.; Pang, Pui Shan; Aliev, Abil E.; Tocher, Derek A.; Porter, Michael J.","Concise synthesis of bicyclic aminals and their evaluation as precursors to the sarain core","Organic & Biomolecular Chemistry","2008","6","16","2941","2951","10.1039/b806031b","","","0.71073","MoKα","","0.043","0.0392","","","0.1028","0.1059","","","","","","1.013","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150953","16.022","0.005","16.416","0.005","32.819","0.01","90","","101.164","0.005","90","","8469","5","90","2","90","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H23 B F2 I2 N2 O2 -","- C19 H23 B F2 I2 N2 O2 -","- C304 H368 B16 F32 I32 N32 O32 -","16","4","","Maeda, Hiromitsu; Haketa, Yohei","Selective iodinated dipyrrolyldiketone BF2 complexes as potential building units for oligomeric systems","Organic & Biomolecular Chemistry","2008","6","17","3091","3095","10.1039/b806161k","","","0.71073","MoKα","","0.0751","0.0658","","","0.1524","0.1608","","","","","","1.253","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7150954","10.962","0.007","11.536","0.006","12.261","0.006","77.123","0.017","75.75","0.02","62.248","0.019","1319.3","1.3","123","2","123","2","","","","","","","","6","P -1","-P 1","2","","","","- C31 H33 B F2 N2 O2 -","- C31 H33 B F2 N2 O2 -","- C62 H66 B2 F4 N4 O4 -","2","1","","Maeda, Hiromitsu; Haketa, Yohei","Selective iodinated dipyrrolyldiketone BF2 complexes as potential building units for oligomeric systems","Organic & Biomolecular Chemistry","2008","6","17","3091","3095","10.1039/b806161k","","","0.71075","MoKα","","0.1034","0.0537","","","0.1485","0.1746","","","","","","0.977","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150955","9.563","0.001","9.483","0.001","18.527","0.003","90","","101.93","0.01","90","","1643.8","0.4","293","2","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H6 Br3 P S3 -","- C12 H6 Br3 P S3 -","- C48 H24 Br12 P4 S12 -","4","1","","Leriche, Philippe; Aillerie, David; Roquet, Sophie; Allain, Magali; Cravino, Antonio; Frère, Pierre; Roncali, Jean","3D-conjugated systems based on oligothiophenes and phosphorus nodes","Organic & Biomolecular Chemistry","2008","6","17","3202","3207","10.1039/b806169f","","x-ray","0.71073","MoKα","","","0.0404","","","","0.096","","","","","","1.061","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150956","9.8214","0.0009","9.4798","0.0008","18.488","0.002","90","","102.87","0.01","90","","1678.1","0.3","293","2","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H6 Br3 O P S3 -","- C12 H6 Br3 O P S3 -","- C48 H24 Br12 O4 P4 S12 -","4","1","","Leriche, Philippe; Aillerie, David; Roquet, Sophie; Allain, Magali; Cravino, Antonio; Frère, Pierre; Roncali, Jean","3D-conjugated systems based on oligothiophenes and phosphorus nodes","Organic & Biomolecular Chemistry","2008","6","17","3202","3207","10.1039/b806169f","","","0.71073","MoKα","","","0.0538","","","","0.1546","","","","","","1.002","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150957","7.2451","0.0007","7.3525","0.0007","9.3666","0.0009","90","","93.255","0.002","90","","498.15","0.08","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C11 H16 O2 -","- C11 H16 O2 -","- C22 H32 O4 -","2","1","","Ramachary, Dhevalapally B.; Sakthidevi, Rajasekar","Combining multi-catalysis and multi-component systems for the development of one-pot asymmetric reactions: stereoselective synthesis of highly functionalized bicyclo[4.4.0]decane-1,6-diones","Organic & Biomolecular Chemistry","2008","6","14","2488","2492","10.1039/b806243a","","","0.71073","MoKα","","0.0429","0.0394","","","0.0988","0.1017","","","","","","1.105","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150958","8.03","0.002","10.027","0.002","22.837","0.005","90","","90","","90","","1838.8","0.7","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 Cl3 N O2 Si -","- C13 H20 Cl3 N O2 Si -","- C52 H80 Cl12 N4 O8 Si4 -","4","1","","Pattenden, Gerald; Rescourio, Gwenaëlla","A new synthetic approach to (+)-lactacystin based on radical cyclisation of enantiopure α-ethynyl substituted serine derivatives to 4-methylenepyrrolidinones","Organic & Biomolecular Chemistry","2008","6","18","3428","3438","10.1039/b806681g","","","0.71073","MoKα","","0.0703","0.0373","","","0.0447","0.0488","","","","","","0.77","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150959","7.8582","0.0005","10.1699","0.0007","11.6933","0.0008","101.767","0.001","103.314","0.001","98.322","0.001","872.06","0.1","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H23 N O3 S -","- C20 H23 N O3 S -","- C40 H46 N2 O6 S2 -","2","1","","Chau, Chi-Min; Liu, Kuan-Miao","Diels‒Alder reactions of three fused nitrogen-containing bicyclic enones: an efficient method toward novel nitrogen-containing angular tricyclic skeletons","Organic & Biomolecular Chemistry","2008","6","17","3127","3134","10.1039/b806773m","","","0.71073","MoKα","","0.0708","0.0479","","","0.1231","0.1329","","","","","","1.034","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150960","9.6137","0.0006","12.345","0.0008","15.2962","0.0009","90","","106.767","0.001","90","","1738.19","0.19","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H21 N O3 S -","- C19 H21 N O3 S -","- C76 H84 N4 O12 S4 -","4","1","","Chau, Chi-Min; Liu, Kuan-Miao","Diels‒Alder reactions of three fused nitrogen-containing bicyclic enones: an efficient method toward novel nitrogen-containing angular tricyclic skeletons","Organic & Biomolecular Chemistry","2008","6","17","3127","3134","10.1039/b806773m","","","0.71073","MoKα","","0.087","0.0576","","","0.1323","0.146","","","","","","1.034","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150961","16.537","0.003","12.716","0.002","16.984","0.003","90","","90","","90","","3571.5","1.1","295","2","295","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C19 H21 N O4 S -","- C19 H21 N O4 S -","- C152 H168 N8 O32 S8 -","8","2","","Chau, Chi-Min; Liu, Kuan-Miao","Diels‒Alder reactions of three fused nitrogen-containing bicyclic enones: an efficient method toward novel nitrogen-containing angular tricyclic skeletons","Organic & Biomolecular Chemistry","2008","6","17","3127","3134","10.1039/b806773m","","","0.71073","MoKα","","0.1826","0.1268","","","0.2733","0.3135","","","","","","1.011","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150962","9.8195","0.0001","25.2307","0.0003","11.4069","0.0002","90","","112.646","0.0005","90","","2608.2","0.06","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C32 H27 N3 O5 -","- C32 H27 N3 O5 -","- C128 H108 N12 O20 -","4","1","","Groenendaal, Bas; Ruijter, Eelco; de Kanter, Frans J. J.; Lutz, Martin; Spek, Anthony L.; Orru, Romano V. A.","Generation of molecular diversity using a complexity-generating MCR-platform towards triazinane diones","Organic & Biomolecular Chemistry","2008","6","17","3158","3165","10.1039/b807138a","","","0.71073","MoKα","","0.0716","0.0464","","","0.1247","0.1416","","","","","","1.085","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150963","9.0489","0.0003","9.1351","0.0003","14.2792","0.0005","96.789","0.002","103.99","0.002","99.109","0.002","1115.71","0.07","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H71 N2 O3 S3 -","- C45 H71 N2 O3 S3 -","- C45 H71 N2 O3 S3 -","1","0.5","","Gu, Rong; Robeyns, Koen; Van Meervelt, Luc; Toppet, Suzanne; Dehaen, Wim","Facile synthesis of novel indolo[3,2-b]carbazole derivatives and a chromogenic-sensing 5,12-dihydroindolo[3,2-b]carbazole","Organic & Biomolecular Chemistry","2008","6","14","2484","2487","10.1039/b807255h","","","1.54178","CuKα","","0.0861","0.0798","","","0.1757","0.1783","","","","","","1.25","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150964","5.7658","0.0009","12.225","0.0015","13.2296","0.0015","79.379","0.007","81.877","0.009","88.968","0.009","907.3","0.2","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C46 H50 N2 -","- C46 H50 N2 -","- C46 H50 N2 -","1","0.5","","Gu, Rong; Robeyns, Koen; Van Meervelt, Luc; Toppet, Suzanne; Dehaen, Wim","Facile synthesis of novel indolo[3,2-b]carbazole derivatives and a chromogenic-sensing 5,12-dihydroindolo[3,2-b]carbazole","Organic & Biomolecular Chemistry","2008","6","14","2484","2487","10.1039/b807255h","","","1.54178","CuKα","","0.0824","0.0577","","","0.1384","0.1523","","","","","","1.024","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150965","11","0.006","12.348","0.006","9.398","0.007","90","","103.58","0.02","90","","1240.8","1.3","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H17 N O2 -","- C13 H17 N O2 -","- C52 H68 N4 O8 -","4","1","","Matsuhira, Takashi; Tsuchihashi, Kazuki; Yamamoto, Hitoshi; Okamura, Taka-aki; Ueyama, Norikazu","Novel photosystem involving protonation and deprotonation processes modelled on a PYP photocycle","Organic & Biomolecular Chemistry","2008","6","17","3118","3126","10.1039/b807417h","","","0.71075","MoKα","","0.1291","0.0697","","","0.1113","0.129","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150966","12.94","0.005","9.252","0.005","20.599","0.011","90","","90","","90","","2466","2","200","2","200","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H17 N O2 -","- C13 H17 N O2 -","- C104 H136 N8 O16 -","8","1","","Matsuhira, Takashi; Tsuchihashi, Kazuki; Yamamoto, Hitoshi; Okamura, Taka-aki; Ueyama, Norikazu","Novel photosystem involving protonation and deprotonation processes modelled on a PYP photocycle","Organic & Biomolecular Chemistry","2008","6","17","3118","3126","10.1039/b807417h","","","0.71075","MoKα","","0.1008","0.0579","","","0.1136","0.1276","","","","","","1.035","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150967","14.495","0.003","15.945","0.004","17.142","0.004","87.527","0.006","68.186","0.004","81.798","0.006","3640.4","1.5","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H35 N9 O9 S5 -","- C27 H35 N9 O9 S5 -","- C108 H140 N36 O36 S20 -","4","2","","Duke, Rebecca M.; O'Brien, John E.; McCabe, Thomas; Gunnlaugsson, Thorfinnur","Colorimetric sensing of anions in aqueous solution using a charge neutral, cleft-like, amidothiourea receptor: tilting the balance between hydrogen bonding and deprotonation in anion recognition","Organic & Biomolecular Chemistry","2008","6","22","4089","4092","10.1039/b807579d","","","0.7107","MoKα","","0.067","0.0623","","","0.1495","0.1534","","","","","","1.063","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150968","7.9717","0.0001","20.6854","0.0003","11.1804","0.0002","90","","101.143","0.0007","90","","1808.87","0.05","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H16 O3 S -","- C25 H16 O3 S -","- C100 H64 O12 S4 -","4","1","","Gabbutt, Christopher D.; Heron, B. Mark; Kolla, Suresh B.; Kilner, Colin; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B.","Ring contraction during the 6π-electrocyclisation of naphthopyran valence tautomers","Organic & Biomolecular Chemistry","2008","6","17","3096","3104","10.1039/b807744d","","x-ray","0.71073","MoKα","","0.0483","0.0396","","","0.1011","0.1084","","","","","","1.058","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150969","19.3719","0.0008","11.51","0.0005","16.4409","0.0006","90","","99.926","0.002","90","","3611","0.3","150","2","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C25 H16 O2 S -","- C25 H16 O2 S -","- C200 H128 O16 S8 -","8","1","","Gabbutt, Christopher D.; Heron, B. Mark; Kolla, Suresh B.; Kilner, Colin; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B.","Ring contraction during the 6π-electrocyclisation of naphthopyran valence tautomers","Organic & Biomolecular Chemistry","2008","6","17","3096","3104","10.1039/b807744d","","","0.71073","MoKα","","0.0486","0.037","","","0.0875","0.0936","","","","","","1.025","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150970","11.1939","0.0005","14.0344","0.0004","11.7187","0.0005","90","","101.498","0.002","90","","1804.06","0.12","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H16 O2 S -","- C25 H16 O2 S -","- C100 H64 O8 S4 -","4","1","","Gabbutt, Christopher D.; Heron, B. Mark; Kolla, Suresh B.; Kilner, Colin; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B.","Ring contraction during the 6π-electrocyclisation of naphthopyran valence tautomers","Organic & Biomolecular Chemistry","2008","6","17","3096","3104","10.1039/b807744d","","","0.71073","MoKα","","0.1094","0.0671","","","0.1124","0.1255","","","","","","1.065","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150971","11.3454","0.0002","13.4896","0.0002","11.5736","0.0003","90","","96.365","0.001","90","","1760.36","0.06","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C25 H16 O2 S -","- C25 H16 O2 S -","- C100 H64 O8 S4 -","4","1","","Gabbutt, Christopher D.; Heron, B. Mark; Kolla, Suresh B.; Kilner, Colin; Coles, Simon J.; Horton, Peter N.; Hursthouse, Michael B.","Ring contraction during the 6π-electrocyclisation of naphthopyran valence tautomers","Organic & Biomolecular Chemistry","2008","6","17","3096","3104","10.1039/b807744d","","","0.71073","MoKα","","0.0389","0.0364","","","0.0926","0.0943","","","","","","1.056","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150972","10.805","0.004","12.994","0.005","7.924","0.003","90","","110.696","0.006","90","","1040.7","0.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","2-(2-nitro-benzyl)-cyclopentane-1, 3-dione (7i)","","","- C12 H11 N O4 -","- C12 H11 N O4 -","- C48 H44 N4 O16 -","4","1","","Ramachary, Dhevalapally B.; Kishor, Mamillapalli","Direct amino acid-catalyzed cascade biomimetic reductive alkylations: application to the asymmetric synthesis of Hajos‒Parrish ketone analogues","Organic & Biomolecular Chemistry","2008","6","22","4176","4187","10.1039/B807999d","","","0.71073","MoKα","","0.0696","0.0422","","","0.1027","0.1157","","","","","","1.021","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150973","9.319","0.003","6.15","0.0017","15.347","0.004","90","","90.088","0.005","90","","879.6","0.4","120","2","120","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H21 N O2 -","- C23 H21 N O2 -","- C46 H42 N2 O4 -","2","1","","Imai, Yoshitane; Kamon, Kensaku; Murata, Katuzo; Harada, Takunori; Nakano, Yoko; Sato, Tomohiro; Fujiki, Michiya; Kuroda, Reiko; Matsubara, Yoshio","Preparation of a spontaneous resolution chiral fluorescent system using 2-anthracenecarboxylic acid","Organic & Biomolecular Chemistry","2008","6","19","3471","3475","10.1039/b808242a","","","0.71073","MoKα","","0.0663","0.0518","","","0.1093","0.1198","","","","","","1.019","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150974","10.9057","0.0009","6.1084","0.0005","14.6448","0.0012","90","","102.431","0.001","90","","952.71","0.14","135","2","135","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H27 N O2 -","- C23 H27 N O2 -","- C46 H54 N2 O4 -","2","1","","Imai, Yoshitane; Kamon, Kensaku; Murata, Katuzo; Harada, Takunori; Nakano, Yoko; Sato, Tomohiro; Fujiki, Michiya; Kuroda, Reiko; Matsubara, Yoshio","Preparation of a spontaneous resolution chiral fluorescent system using 2-anthracenecarboxylic acid","Organic & Biomolecular Chemistry","2008","6","19","3471","3475","10.1039/b808242a","","","0.71073","MoKα","","0.0559","0.0453","","","0.1058","0.1123","","","","","","1.014","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150975","18.2494","0.0014","6.5375","0.0005","17.7953","0.0013","90","","99.532","0.001","90","","2093.8","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H27 N O2 -","- C26 H27 N O2 -","- C104 H108 N4 O8 -","4","1","","Imai, Yoshitane; Kamon, Kensaku; Murata, Katuzo; Harada, Takunori; Nakano, Yoko; Sato, Tomohiro; Fujiki, Michiya; Kuroda, Reiko; Matsubara, Yoshio","Preparation of a spontaneous resolution chiral fluorescent system using 2-anthracenecarboxylic acid","Organic & Biomolecular Chemistry","2008","6","19","3471","3475","10.1039/b808242a","","","0.71073","MoKα","","0.094","0.0674","","","0.1367","0.1486","","","","","","1.108","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150976","7.76","0.001","10.508","0.001","15.461","0.001","90","","90","","90","","1260.7","0.2","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6-bromo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydro-naphthalene","","- C14 H19 Br -","- C14 H19 Br -","- C56 H76 Br4 -","4","1","","Christie, Victoria B.; Barnard, Jonathan H.; Batsanov, Andrei S.; Bridgens, Caroline E.; Cartmell, Emily B.; Collings, Jonathan C.; Maltman, Daniel J.; Redfern, Christopher P. F.; Marder, Todd B.; Przyborski, Stefan; Whiting, Andrew","Synthesis and evaluation of synthetic retinoid derivatives as inducers of stem cell differentiation","Organic & Biomolecular Chemistry","2008","6","19","3497","3507","10.1039/b808574a","","","0.71073","MoKα","","0.0201","0.017","","","0.0402","0.0413","","","","","","1.077","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150977","6.0434","0.0007","13.3512","0.0015","22.597","0.002","90","","90","","90","","1823.3","0.3","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","6-trimethylsilylethynyl-1,1,4,4-tetramethyl-1,2,3,4- tetrahydronaphthalene","","- C19 H28 Si -","- C19 H28 Si -","- C76 H112 Si4 -","4","1","","Christie, Victoria B.; Barnard, Jonathan H.; Batsanov, Andrei S.; Bridgens, Caroline E.; Cartmell, Emily B.; Collings, Jonathan C.; Maltman, Daniel J.; Redfern, Christopher P. F.; Marder, Todd B.; Przyborski, Stefan; Whiting, Andrew","Synthesis and evaluation of synthetic retinoid derivatives as inducers of stem cell differentiation","Organic & Biomolecular Chemistry","2008","6","19","3497","3507","10.1039/b808574a","","","0.71073","MoKα","","0.0431","0.0349","","","0.0772","0.0813","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150978","8.3245","0.0007","14.6772","0.0012","10.6166","0.0009","90","","102.35","0.01","90","","1267.12","0.19","120","2","120","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","6-Ethynyl-1,1,4,4-tetramethyl-1,2,3,4-tetrahydronaphthalene","","- C16 H20 -","- C16 H20 -","- C64 H80 -","4","1","","Christie, Victoria B.; Barnard, Jonathan H.; Batsanov, Andrei S.; Bridgens, Caroline E.; Cartmell, Emily B.; Collings, Jonathan C.; Maltman, Daniel J.; Redfern, Christopher P. F.; Marder, Todd B.; Przyborski, Stefan; Whiting, Andrew","Synthesis and evaluation of synthetic retinoid derivatives as inducers of stem cell differentiation","Organic & Biomolecular Chemistry","2008","6","19","3497","3507","10.1039/b808574a","","","0.71073","MoKα","","0.0621","0.0497","","","0.1214","0.1287","","","","","","1.029","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150979","8.3105","0.001","10.699","0.0013","15.0376","0.0019","90","","99.67","0.01","90","","1318.1","0.3","125","2","125","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","6-iodo-1,1,4,4-tetramethyl-1,2,3,4-tetrahydronaphthalene","","- C14 H19 I -","- C14 H19 I -","- C56 H76 I4 -","4","1","","Christie, Victoria B.; Barnard, Jonathan H.; Batsanov, Andrei S.; Bridgens, Caroline E.; Cartmell, Emily B.; Collings, Jonathan C.; Maltman, Daniel J.; Redfern, Christopher P. F.; Marder, Todd B.; Przyborski, Stefan; Whiting, Andrew","Synthesis and evaluation of synthetic retinoid derivatives as inducers of stem cell differentiation","Organic & Biomolecular Chemistry","2008","6","19","3497","3507","10.1039/b808574a","","","0.71073","MoKα","","0.0255","0.0209","","","0.0496","0.0511","","","","","","1.032","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150980","8.0253","0.0004","8.1167","0.0003","15.0326","0.0007","90","0.01","84.5","0.01","79.19","0.01","957.24","0.08","120","2","120","2","","","","","","","","3","P -1","-P 1","2","","4-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2- ylethynyl)benzoic acid methyl ester","","- C24 H26 O2 -","- C24 H26 O2 -","- C48 H52 O4 -","2","1","","Christie, Victoria B.; Barnard, Jonathan H.; Batsanov, Andrei S.; Bridgens, Caroline E.; Cartmell, Emily B.; Collings, Jonathan C.; Maltman, Daniel J.; Redfern, Christopher P. F.; Marder, Todd B.; Przyborski, Stefan; Whiting, Andrew","Synthesis and evaluation of synthetic retinoid derivatives as inducers of stem cell differentiation","Organic & Biomolecular Chemistry","2008","6","19","3497","3507","10.1039/b808574a","","","1.54178","CuKα","","0.0481","0.0458","","","0.1266","0.1287","","","","","","1.032","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150981","14.2333","0.0016","5.9012","0.0006","23.004","0.002","90","","90.534","0.003","90","","1932.1","0.3","120","2","120","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","3-(5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2- ylethynyl)benzoic acid methyl ester","","- C24 H26 O2 -","- C24 H26 O2 -","- C96 H104 O8 -","4","1","","Christie, Victoria B.; Barnard, Jonathan H.; Batsanov, Andrei S.; Bridgens, Caroline E.; Cartmell, Emily B.; Collings, Jonathan C.; Maltman, Daniel J.; Redfern, Christopher P. F.; Marder, Todd B.; Przyborski, Stefan; Whiting, Andrew","Synthesis and evaluation of synthetic retinoid derivatives as inducers of stem cell differentiation","Organic & Biomolecular Chemistry","2008","6","19","3497","3507","10.1039/b808574a","","","0.71073","MoKα","","0.0651","0.0436","","","0.099","0.1077","","","","","","1.027","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150982","8.5833","0.0017","10.109","0.002","10.778","0.002","106.89","0.03","92.62","0.03","108.79","0.03","837.1","0.4","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C18 H14 F3 N O4 S -","- C18 H14 F3 N O4 S -","- C36 H28 F6 N2 O8 S2 -","2","1","","Niu, Hao-Tao; Su, Dongdong; Jiang, Xueliang; Yang, Wenzhi; Yin, Zhenming; He, Jiaqi; Cheng, Jin-Pei","A simple yet highly selective colorimetric sensor for cyanide anion in an aqueous environment","Organic & Biomolecular Chemistry","2008","6","17","3038","3040","10.1039/b808589g","","","0.71073","MoKα","","0.045","0.0359","","","0.1042","0.1081","","","","","","1.059","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150983","8.5309","0.0004","11.6667","0.0006","20.2195","0.0011","90","","100.9","0.004","90","","1976.09","0.18","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H25 N O3 S -","- C21 H25 N O3 S -","- C84 H100 N4 O12 S4 -","4","2","","Cariou, Claire A. M.; Kariuki, Benson M.; Snaith, John S.","Stereoselective synthesis of 2,4,5-trisubstituted piperidines by carbonyl ene and Prins cyclisations","Organic & Biomolecular Chemistry","2008","6","18","3337","3348","10.1039/B808644c","","","1.54178","CuKα","","0.036","0.0326","","","0.0809","0.0835","","","","","","1.011","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150984","9.7846","0.0005","20.8046","0.0011","9.7963","0.0005","90","","109.656","0.004","90","","1877.98","0.17","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 Cl N O5 S -","- C16 H21 Cl N O5 S -","- C64 H84 Cl4 N4 O20 S4 -","4","1","","Cariou, Claire A. M.; Kariuki, Benson M.; Snaith, John S.","Stereoselective synthesis of 2,4,5-trisubstituted piperidines by carbonyl ene and Prins cyclisations","Organic & Biomolecular Chemistry","2008","6","18","3337","3348","10.1039/B808644c","","","1.54178","CuKα","","0.0611","0.0575","","","0.1897","0.1955","","","","","","1.032","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150985","10.6519","0.0002","11.7291","0.0002","14.7538","0.0003","74.598","0.001","82.568","0.001","64.379","0.001","1602.14","0.05","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H19 N O4 S -","- C16 H19 N O4 S -","- C64 H76 N4 O16 S4 -","4","2","","Cariou, Claire A. M.; Kariuki, Benson M.; Snaith, John S.","Stereoselective synthesis of 2,4,5-trisubstituted piperidines by carbonyl ene and Prins cyclisations","Organic & Biomolecular Chemistry","2008","6","18","3337","3348","10.1039/B808644c","","","1.54178","CuKα","","0.0721","0.0531","","","0.1411","0.1589","","","","","","1.039","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150986","9.6771","0.0012","8.3153","0.0012","12.6634","0.0017","90","","103.075","0.007","90","","992.6","0.2","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H25 N O3 S -","- C21 H25 N O3 S -","- C42 H50 N2 O6 S2 -","2","1","","Cariou, Claire A. M.; Kariuki, Benson M.; Snaith, John S.","Stereoselective synthesis of 2,4,5-trisubstituted piperidines by carbonyl ene and Prins cyclisations","Organic & Biomolecular Chemistry","2008","6","18","3337","3348","10.1039/B808644c","","","0.71069","MoKα","","0.0469","0.043","","","0.0917","0.095","","","","","","1.149","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150987","7.7495","0.0007","10.1805","0.0009","13.3793","0.0012","93.494","0.002","91.931","0.002","109.458","0.002","991.77","0.15","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H22 O6 -","- C23 H22 O6 -","- C46 H44 O12 -","2","1","","Jiang, Xuefeng; Kong, Wangqing; Chen, Jie; Ma, Shengming","Intermolecular sequential [4 + 2]-cycloaddition‒aromatization reaction of aryl-substituted allenes with DMAD affording phenanthrene and naphthalene derivatives","Organic & Biomolecular Chemistry","2008","6","19","3606","3610","10.1039/b808767a","","","0.71073","MoKα","","0.0693","0.0525","","","0.1429","0.1539","","","","","","1.025","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150988","11.33","0.01","22","0.019","9.42","0.008","90","","98.108","0.015","90","","2325","3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H23 O5 P -","- C27 H23 O5 P -","- C108 H92 O20 P4 -","4","1","","Jiang, Xuefeng; Kong, Wangqing; Chen, Jie; Ma, Shengming","Intermolecular sequential [4 + 2]-cycloaddition‒aromatization reaction of aryl-substituted allenes with DMAD affording phenanthrene and naphthalene derivatives","Organic & Biomolecular Chemistry","2008","6","19","3606","3610","10.1039/b808767a","","","0.71073","MoKα","","0.0804","0.056","","","0.1453","0.158","","","","","","0.948","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150989","25.808","0.002","19.667","0.002","25.792","0.002","90","","93.206","0.007","90","","13071","2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C72 H80 N8 O13 -","- C72 H80 N8 O13 -","- C576 H640 N64 O104 -","8","2","","Meshcheryakov, Denys; Arnaud-Neu, Françoise; Böhmer, Volker; Bolte, Michael; Cavaleri, Julien; Hubscher-Bruder, Véronique; Thondorf, Iris; Werner, Sabine","Cyclic tetraureas with variable flexibility ‒ synthesis, crystal structures and properties","Organic & Biomolecular Chemistry","2008","6","18","3244","3255","10.1039/b808773c","","","0.71073","MoKα","","0.2012","0.0476","","","0.0663","0.0915","","","","","","0.562","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150990","14.9282","0.0013","18.9297","0.0017","19.2836","0.0016","61.351","0.006","86.758","0.007","71.553","0.007","4506.7","0.8","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C89 H106 N10 O8 -","- C89 H106 N10 O8 -","- C178 H212 N20 O16 -","2","1","","Meshcheryakov, Denys; Arnaud-Neu, Françoise; Böhmer, Volker; Bolte, Michael; Cavaleri, Julien; Hubscher-Bruder, Véronique; Thondorf, Iris; Werner, Sabine","Cyclic tetraureas with variable flexibility ‒ synthesis, crystal structures and properties","Organic & Biomolecular Chemistry","2008","6","18","3244","3255","10.1039/b808773c","","","0.71073","MoKα","","0.1361","0.0992","","","0.286","0.3104","","","","","","1.187","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150991","29.728","0.0013","16.135","0.0005","20.0431","0.0009","90","","107.696","0.003","90","","9159","0.7","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C95 H130 N8 O13 -","- C95 H130 N8 O13 -","- C380 H520 N32 O52 -","4","1","","Meshcheryakov, Denys; Arnaud-Neu, Françoise; Böhmer, Volker; Bolte, Michael; Cavaleri, Julien; Hubscher-Bruder, Véronique; Thondorf, Iris; Werner, Sabine","Cyclic tetraureas with variable flexibility ‒ synthesis, crystal structures and properties","Organic & Biomolecular Chemistry","2008","6","18","3244","3255","10.1039/b808773c","","","0.71073","MoKα","","0.1171","0.0873","","","0.2404","0.2593","","","","","","1.015","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150992","24.5125","0.0002","9.8211","0.0001","30.9595","0.0004","90","","106.71","0.0005","90","","7138.47","0.13","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C17.5 H18 Cl6.67 N0.67 O4.67 -","- C17.5 H18 Cl6.66667 N0.666667 O4.66667 -","- C210 H216 Cl80 N8 O56 -","12","1.5","","Aciro, Caroline; Claridge, Timothy D. W.; Davies, Stephen G.; Roberts, Paul M.; Russell, Angela J.; Thomson, James E.","Ammonium-directed dihydroxylation of 3-aminocyclohex-1-enes: development of a metal-free dihydroxylation protocol","Organic & Biomolecular Chemistry","2008","6","20","3751","3761","10.1039/b808811j","","","0.71073","MoKα","","0.1129","0.0918","","0.1107","0.0951","0.0951","","","","","","1.0849","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150993","10.8392","0.0001","28.0222","0.0003","12.2118","0.0001","90","","110.557","0.0005","90","","3473","0.06","150","","150","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C20 H25 N O2 -","- C20 H25 N O2 -","- C160 H200 N8 O16 -","8","2","","Aciro, Caroline; Davies, Stephen G.; Roberts, Paul M.; Russell, Angela J.; Smith, Andrew D.; Thomson, James E.","Ammonium-directed dihydroxylation: metal-free synthesis of the diastereoisomers of 3-aminocyclohexane-1,2-diol","Organic & Biomolecular Chemistry","2008","6","20","3762","3770","10.1039/b808812h","","","0.71073","MoKα","","0.085","0.0453","","0.0861","0.0459","0.0426","","","","","","1.1211","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150994","7.6397","0.0009","10.614","0.001","10.778","0.001","83.827","0.008","80.863","0.009","79.643","0.009","846","0.15","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C16 H19 N O5 S -","- C16 H19 N O5 S -","- C32 H38 N2 O10 S2 -","2","1","","Horino, Yoshikazu; Takata, Yasushi; Hashimoto, Ken; Kuroda, Shigeyasu; Kimura, Masanari; Tamaru, Yoshinao","Gold-catalyzed intermolecular addition of alcohols toward the allenic bond of 4-vinylidene-2-oxazolidinones","Organic & Biomolecular Chemistry","2008","6","22","4105","4107","10.1039/b808921c","","","0.7107","MoKα","","","0.0502","","","","0.1437","","","","","","1.894","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7150995","13.838","0.011","6.873","0.006","22.068","0.019","90","","96.71","0.015","90","","2084","3","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1,2-Bis[3'-azido-4'-phenylazetidine-2'-one-1'-yl]ethane","","- C20 H18 N8 O2 -","- C20 H18 N8 O2 -","- C80 H72 N32 O8 -","4","1","","Vatmurge, Namdev S.; Hazra, Braja G.; Pore, Vandana S.; Shirazi, Fazal; Deshpande, Mukund V.; Kadreppa, Sreenath; Chattopadhyay, Samit; Gonnade, Rajesh G.","Synthesis and biological evaluation of bile acid dimers linked with 1,2,3-triazole and bis-β-lactam","Organic & Biomolecular Chemistry","2008","6","20","3823","3830","10.1039/B809221d","","","0.71073","MoKα","","0.0699","0.0541","","","0.1327","0.1433","","","","","","1.068","","","","has coordinates,has disorder","180295","2020-10-21","18:00:00",""
"7150996","13.196","0.008","5.751","0.004","13.632","0.008","90","","109.453","0.009","90","","975.5","1.1","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","1-[3'-azido-4'-phenylazetidine-2'-one-1'-yl]-2- [3""-azido-4""-phenylazetidine-2""-one-1""-yl]ethane","","- C20 H18 N8 O2 -","- C20 H18 N8 O2 -","- C40 H36 N16 O4 -","2","0.5","","Vatmurge, Namdev S.; Hazra, Braja G.; Pore, Vandana S.; Shirazi, Fazal; Deshpande, Mukund V.; Kadreppa, Sreenath; Chattopadhyay, Samit; Gonnade, Rajesh G.","Synthesis and biological evaluation of bile acid dimers linked with 1,2,3-triazole and bis-β-lactam","Organic & Biomolecular Chemistry","2008","6","20","3823","3830","10.1039/B809221d","","","0.71073","MoKα","","0.0399","0.0359","","","0.0896","0.093","","","","","","1.07","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7150997","6.088","0.0012","14.543","0.003","9.779","0.002","90","","90.63","0.03","90","","865.8","0.3","113","2","113","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H21 Cl N2 O -","- C20 H21 Cl N2 O -","- C40 H42 Cl2 N4 O2 -","2","1","","Kang, Tai-Ran; Xie, Jian-Wu; Du, Wei; Feng, Xin; Chen, Ying-Chun","Stereoselective desymmetrisation of prochiral α,α-dicyanoalkenes via domino Michael‒Michael addition reactions","Organic & Biomolecular Chemistry","2008","6","15","2673","2675","10.1039/b809308c","","","0.71073","MoKα","","0.0332","0.0294","","","0.0737","0.0753","","","","","","1.061","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150998","8.3859","0.0013","10.982","0.0014","11.3351","0.0016","109.105","0.011","95.714","0.012","93.578","0.012","976.5","0.3","295","2","295","2","","","","","","","","3","P -1","-P 1","2","1-((1-Methoxycyclohexyl)peroxy)cyclododecyl hydroperoxide","1-[(1-Methoxycyclohexyl)peroxy]cyclododecyl hydroperoxide","","- C19 H36 O5 -","- C19 H36 O5 -","- C38 H72 O10 -","2","1","","Terent'ev, Alexander O.; Platonov, Maxim M.; Krylov, Igor B.; Chernyshev, Vladimir V.; Nikishin, Gennady I.","Synthesis of 1-hydroperoxy-1′-alkoxyperoxides by the iodine-catalyzed reactions of geminal bishydroperoxides with acetals or enol ethers","Organic & Biomolecular Chemistry","2008","6","23","4435","4441","10.1039/b809661a","","x-ray","1.54184","CuKα","","0.1259","0.0518","","","0.1215","0.1959","","","","","","0.936","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7150999","16.4885","0.0003","26.3581","0.0006","23.3178","0.0005","90","","109.279","0.001","90","","9565.7","0.4","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C88 H129 Cl2 N9 O19 Zn -","- C88 H127 Cl2 N9 O19 Zn -","- C352 H508 Cl8 N36 O76 Zn4 -","4","1","","Coquière, David; Marrot, Jérôme; Reinaud, Olivia","Spectacular induced-fit process for guest binding by a calix[6]arene Zn(ii) funnel complex","Organic & Biomolecular Chemistry","2008","6","21","3930","3934","10.1039/b809699f","","","0.71073","MoKα","","0.0874","0.0608","","","0.1782","0.1922","","","","","","1.109","","","","has coordinates","180295","2020-10-21","18:00:00",""
"7151000","16.0388","0.0006","16.3548","0.0007","20.0055","0.0009","75.968","0.002","78.527","0.002","88.231","0.002","4988.5","0.4","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","","","- C82 H102 Cl2 N10 O16 Zn -","- C82 H102 Cl2 N10 O16 Zn -","- C164 H204 Cl4 N20 O32 Zn2 -","2","1","","Coquière, David; Marrot, Jérôme; Reinaud, Olivia","Spectacular induced-fit process for guest binding by a calix[6]arene Zn(ii) funnel complex","Organic & Biomolecular Chemistry","2008","6","21","3930","3934","10.1039/b809699f","","","0.71073","MoKα","","0.1435","0.0741","","","0.1927","0.2158","","","","","","0.869","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151001","19.874","0.003","25.382","0.004","23.188","0.003","90","","114.988","0.006","90","","10602","3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C79 H96 Cl2 N10 O14 Zn -","- C79 H96 Cl2 N10 O14 Zn -","- C316 H384 Cl8 N40 O56 Zn4 -","4","1","","Coquière, David; Marrot, Jérôme; Reinaud, Olivia","Spectacular induced-fit process for guest binding by a calix[6]arene Zn(ii) funnel complex","Organic & Biomolecular Chemistry","2008","6","21","3930","3934","10.1039/b809699f","","","0.71073","MoKα","","0.191","0.1406","","","0.3437","0.3715","","","","","","1.04","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151002","15.488","0.003","8.544","0.0017","10.372","0.002","90","","108.95","0.03","90","","1298.1","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 Cl O5 S -","- C11 H11 Cl O5 S -","- C44 H44 Cl4 O20 S4 -","4","1","","Rahn, Thomas; Dang, T. H. Tam; Spannenberg, Anke; Fischer, Christine; Langer, Peter","Regioselective synthesis of functionalized 3,5-diketoesters and 2,4-diketosulfones by uncatalyzed condensation of 1-methoxy-1,3-bis(trimethylsilyloxy)-1,3-butadienes with α,β-unsaturated acid chlorides and sulfonyl chlorides","Organic & Biomolecular Chemistry","2008","6","18","3366","3370","10.1039/b810151e","","","0.71073","MoKα","","0.087","0.0442","","","0.0979","0.1065","","","","","","0.852","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151003","13.076","0.004","4.98","0.002","21.362","0.011","90","","103.18","0.03","90","","1354.4","1","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H11 N O2 -","- C10 H11 N O2 -","- C60 H66 N6 O12 -","6","3","","Boyd, Derek R.; Sharma, Narain D.; Coen, Gerard P.; Hempenstall, Francis; Ljubez, Vera; Malone, John F.; Allen, Christopher C. R.; Hamilton, John T. G.","Regioselectivity and stereoselectivity of dioxygenase catalysed cis-dihydroxylation of mono- and tri-cyclic azaarene substrates","Organic & Biomolecular Chemistry","2008","6","21","3957","3966","10.1039/b810235j","","","1.54178","CuKα","","0.0752","0.0741","","","0.2037","0.2061","","","","","","1.033","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151004","15.561","0.006","6.152","0.002","11.984","0.006","90","","122.08","0.03","90","","972.1","0.8","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C11 H13 N O2 -","- C11 H13 N O2 -","- C44 H52 N4 O8 -","4","1","","Boyd, Derek R.; Sharma, Narain D.; Coen, Gerard P.; Hempenstall, Francis; Ljubez, Vera; Malone, John F.; Allen, Christopher C. R.; Hamilton, John T. G.","Regioselectivity and stereoselectivity of dioxygenase catalysed cis-dihydroxylation of mono- and tri-cyclic azaarene substrates","Organic & Biomolecular Chemistry","2008","6","21","3957","3966","10.1039/b810235j","","","1.54178","CuKα","","0.0324","0.0321","","","0.0844","0.0848","","","","","","1.141","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151005","13.2254","0.0013","11.3377","0.0012","14.1441","0.0015","90","","117.874","0.002","90","","1874.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H15 N5 O2 -","- C21 H15 N5 O2 -","- C84 H60 N20 O8 -","4","1","","Guan, Xiao-Yang; Shi, Min","A convenient three-component reaction leading to the synthesis of polysubstituted cyclohexene derivatives","Organic & Biomolecular Chemistry","2008","6","19","3616","3620","10.1039/b810299f","","","0.71073","MoKα","","0.0884","0.0561","","","0.1011","0.1131","","","","","","0.993","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151006","23.2536","0.001","23.2536","0.001","17.77","0.0011","90","","90","","120","","8321.4","0.7","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C21 H16 N5 O2.33 -","- C21 H16 N5 O2.33333 -","- C378 H288 N90 O42 -","18","1","","Guan, Xiao-Yang; Shi, Min","A convenient three-component reaction leading to the synthesis of polysubstituted cyclohexene derivatives","Organic & Biomolecular Chemistry","2008","6","19","3616","3620","10.1039/b810299f","","","0.71073","MoKα","","0.0744","0.0514","","","0.133","0.1418","","","","","","1.02","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151007","10.4911","0.0005","12.2289","0.0006","16.1319","0.0007","90","","90","","90","","2069.64","0.17","110","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H24 N2 O4 -","- C24 H24 N2 O4 -","- C96 H96 N8 O16 -","4","1","","Farran, Daniel; Parrot, Isabelle; Toupet, Loïc; Martinez, Jean; Dewynter, Georges","Transannular rearrangement of activated 2,5-diketopiperazines: a key route to original scaffolds","Organic & Biomolecular Chemistry","2008","6","21","3989","3996","10.1039/b810352f","","","0.71069","MoKα","","0.0351","0.0267","","","0.0697","0.0728","","","","","","0.724","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151008","17.454","0.003","9.6156","0.0013","16.561","0.002","90","","109.463","0.004","90","","2620.6","0.7","93","2","93","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H30 N4 O S2 Si -","- C25 H30 N4 O S2 Si -","- C100 H120 N16 O4 S8 Si4 -","4","1","","Kirkman, Joseph K.; Lindell, Stephen D.; Maechling, Simon; Slawin, Alexandra M. Z.; Moody, Christopher J.","Synthesis of 3-(carboxyarylalkyl)imidazo[2,1-f][1,2,4]triazines as potential inhibitors of AMP deaminase","Organic & Biomolecular Chemistry","2008","6","23","4452","4459","10.1039/b810850a","","","0.71073","MoKα","","0.0313","0.0292","","","0.074","0.0757","","","","","","1.005","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151009","8.342","0.001","5.8896","0.0007","26.712","0.003","90","","90.634","0.002","90","","1312.3","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H15 N O4 -","- C15 H15 N O4 -","- C60 H60 N4 O16 -","4","1","","Linder, Jörg; Blake, Alexander J.; Moody, Christopher J.","Total synthesis of siphonazole and its O-methyl derivative, structurally unusual bis-oxazole natural products","Organic & Biomolecular Chemistry","2008","6","21","3908","3916","10.1039/b810855b","","","0.71073","MoKα","","0.0492","0.0429","","","0.117","0.122","","","","","","1.06","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151010","14.3877","0.0007","16.3592","0.0007","21.4727","0.001","90","","90","","90","","5054.1","0.4","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C55 H61 F6 N3 O P2 Pd -","- C55 H61 F6 N3 O P2 Pd -","- C220 H244 F24 N12 O4 P8 Pd4 -","4","1","","Maxwell, Aoife C.; Franc, Celine; Pouchain, Laurent; Müller-Bunz, Helge; Guiry, Patrick J.","Electronically varied quinazolinaps for asymmetric catalysis","Organic & Biomolecular Chemistry","2008","6","20","3848","3853","10.1039/b810936b","","","0.71073","MoKα","","0.0367","0.0333","","","0.0761","0.0777","","","","","","1.082","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151011","5.835","0.003","8.91","0.004","12.876","0.005","69.902","0.006","78.323","0.007","80.933","0.007","612.8","0.5","193","2","193","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H6 Br N O3 -","- C15 H6 Br N O3 -","- C30 H12 Br2 N2 O6 -","2","1","","Jones, Paul B.; Brinson, Robert G.; Sarma, Saurav J.; Elkazaz, Salwa","Observation of heavy atom effects in the development of water soluble caged 4-hydroxy-trans-2-nonenal","Organic & Biomolecular Chemistry","2008","6","22","4204","4211","10.1039/B810954k","","","0.71073","MoKα","","0.0602","0.0428","","","0.0924","0.0999","","","","","","1.005","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151012","9.8353","0.0007","17.4256","0.0013","31.038","0.002","90","","90","","90","","5319.5","0.6","110","2","110","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H17 N O3 S -","- C13 H17 N O3 S -","- C208 H272 N16 O48 S16 -","16","4","","Coote, Susannah C.; O'Brien, Peter; Whitwood, Adrian C.","Stereoselective aziridination of cyclic allylic alcohols using chloramine-T","Organic & Biomolecular Chemistry","2008","6","23","4299","4314","10.1039/b811137e","","","0.71073","MoKα","","0.0645","0.06","","","0.1625","0.1647","","","","","","1.141","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151013","12.94","0.003","12.042","0.002","11.54","0.002","90","","93.062","0.004","90","","1795.6","0.6","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H27 N O3 S -","- C18 H27 N O3 S -","- C72 H108 N4 O12 S4 -","4","1","","Coote, Susannah C.; O'Brien, Peter; Whitwood, Adrian C.","Stereoselective aziridination of cyclic allylic alcohols using chloramine-T","Organic & Biomolecular Chemistry","2008","6","23","4299","4314","10.1039/b811137e","","","0.71073","MoKα","","0.0576","0.044","","","0.116","0.1258","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151014","9.2925","0.0001","12.9908","0.0002","28.111","0.0004","90","","90","","90","","3393.48","0.08","296.2","","296.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C36 H51 N O4 -","- C36 H51 N O4 -","- C144 H204 N4 O16 -","4","1","","Tayama, Eiji; Orihara, Kiwako; Kimura, Hiroshi","New synthetic routes to optically active α-quaternary α-aryl amino acid derivatives via the diastereoselective Stevens and Sommelet‒Hauser rearrangements","Organic & Biomolecular Chemistry","2008","6","20","3673","3680","10.1039/b811162f","","","0.7107","MoKα","","","0.0572","","","","0.1235","","","","","","1.225","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151015","7.2351","0.0007","25.532","0.002","12.0626","0.0012","90","","104.539","0.002","90","","2156.9","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H23 N O8 -","- C23 H23 N O8 -","- C92 H92 N4 O32 -","4","1","","Clark, J. Stephen; Northall, John M.; Marlin, Frédéric; Nay, Bastien; Wilson, Claire; Blake, Alexander J.; Waring, Michael J.","Synthetic studies on the cornexistins: synthesis of (±)-5-epi-hydroxycornexistin","Organic & Biomolecular Chemistry","2008","6","21","4012","4025","10.1039/b811245b","","","0.71073","MoKα","","0.0525","0.0406","","","0.113","0.1205","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151016","10.3476","0.0007","12.7195","0.0009","11.1244","0.0008","90","","114.035","0.002","90","","1337.21","0.16","150","2","150","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H18 O3 -","- C16 H18 O3 -","- C64 H72 O12 -","4","1","","Clark, J. Stephen; Northall, John M.; Marlin, Frédéric; Nay, Bastien; Wilson, Claire; Blake, Alexander J.; Waring, Michael J.","Synthetic studies on the cornexistins: synthesis of (±)-5-epi-hydroxycornexistin","Organic & Biomolecular Chemistry","2008","6","21","4012","4025","10.1039/b811245b","","","0.71073","MoKα","","0.0497","0.0435","","","0.118","0.122","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151017","8.1515","0.0008","10.0702","0.001","10.3368","0.001","71.999","0.002","80.438","0.002","71.163","0.002","761.69","0.13","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H18 O3 -","- C22 H18 O3 -","- C44 H36 O6 -","2","1","","Moulton, Benjamin E.; Dong, Hao; O'Brien, Ciara T.; Duckett, Simon B.; Lin, Zhenyang; Fairlamb, Ian J. S.","A natural light induced regioselective 6π-electrocyclisation‒oxidative aromatisation reaction: experimental and theoretical insights","Organic & Biomolecular Chemistry","2008","6","24","4523","4532","10.1039/b811284c","","","0.71073","MoKα","","0.0624","0.0457","","","0.1169","0.1269","","","","","","1.031","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151018","8.0227","0.0003","8.8488","0.0004","31.8469","0.0013","90","","90","","90","","2260.85","0.16","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C22 H32 N O8 P -","- C22 H32 N O8 P -","- C88 H128 N4 O32 P4 -","4","1","","Liu, Xue-Wei; Le, Thanh Nguyen; Lu, Yunpeng; Xiao, Yongjun; Ma, Jimei; Li, Xingwei","An efficient synthesis of chiral phosphinyl oxide pyrrolidines and their application to asymmetric direct aldol reactions","Organic & Biomolecular Chemistry","2008","6","21","3997","4003","10.1039/b811581h","","","0.71073","MoKα","","0.0477","0.0442","","","0.1291","0.1384","","","","","","1.127","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151019","7.8768","0.0002","11.7807","0.0003","14.3679","0.0003","90","","94.8778","0.0011","90","","1328.43","0.06","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 N O3 -","- C15 H17 N O3 -","- C60 H68 N4 O12 -","4","1","","Chandan, Nandkishkor; Moloney, Mark G.","Rapid diastereocontrolled synthesis of 2,2,5-trisubstituted pyrrolidines","Organic & Biomolecular Chemistry","2008","6","20","3664","3666","10.1039/b811642c","","","0.71073","MoKα","","0.0715","0.0511","","0.1347","0.127","0.1347","","","","","","0.9993","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151020","6.9787","0.0002","14.2583","0.0004","9.8765","0.0003","90","","107.733","0.0014","90","","936.06","0.05","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C9 H13 N O3 -","- C9 H13 N O3 -","- C36 H52 N4 O12 -","4","1","","Chandan, Nandkishkor; Moloney, Mark G.","Rapid diastereocontrolled synthesis of 2,2,5-trisubstituted pyrrolidines","Organic & Biomolecular Chemistry","2008","6","20","3664","3666","10.1039/b811642c","","","0.71073","MoKα","","0.0548","0.0389","","0.0935","0.0879","0.0935","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151021","6.5272","0.001","12.559","0.002","10.5571","0.0019","90","","93.26","0.006","90","","864","0.2","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H11 N O3 -","- C8 H11 N O3 -","- C32 H44 N4 O12 -","4","1","","Chandan, Nandkishkor; Moloney, Mark G.","Rapid diastereocontrolled synthesis of 2,2,5-trisubstituted pyrrolidines","Organic & Biomolecular Chemistry","2008","6","20","3664","3666","10.1039/b811642c","","","0.71073","MoKα","","0.064","0.049","","0.1239","0.1133","0.1234","","","","","","1","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151022","10.974","0.005","14.927","0.006","9.978","0.004","90","","95.267","0.006","90","","1627.6","1.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H16 N2 O -","- C21 H16 N2 O -","- C84 H64 N8 O4 -","4","1","","Ye, Shengqing; Ding, Qiuping; Wang, Zhiyong; Zhou, Haibo; Wu, Jie","Tandem addition-cyclization reactions of 2-alkynylbenzenamines with isocyanates catalyzed by PdCl2","Organic & Biomolecular Chemistry","2008","6","23","4406","4412","10.1039/B812015c","","","0.71073","MoKα","","0.083","0.0505","","","0.1155","0.1226","","","","","","0.805","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151023","13.123","0.0009","7.1019","0.0005","14.4491","0.001","90","","90.077","0.004","90","","1346.63","0.16","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","13-(2',3',4'-Tri-O-acetyl-β-L-rhamnopyranosyl)-5,12,13- triazaindeno[1,2-b]anthracene","","- C30 H27 N3 O7 -","- C30 H27 N3 O7 -","- C60 H54 N6 O14 -","2","1","","Driller, Katrin Marie; Libnow, Stefanie; Hein, Martin; Harms, Manuela; Wende, Kristian; Lalk, Michael; Michalik, Dirk; Reinke, Helmut; Langer, Peter","Synthesis of 6H-indolo[2,3-b]quinoxaline-N-glycosides and their cytotoxic activity against human ceratinocytes (HaCaT)","Organic & Biomolecular Chemistry","2008","6","22","4218","4223","10.1039/b812308j","","","0.71073","MoKα","","0.1021","0.0441","","","0.0808","0.0966","","","","","","0.995","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151024","6.48","0.0001","10.5889","0.0002","41.9162","0.0009","90","","90","","90","","2876.12","0.09","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","2,3-Dimethyl-6-(2',3',4',6'-tetra-O-acetyl-β-D-manno- pyranosyl)indolo[2,3-b]quinoxaline","","- C30 H31 N3 O9 -","- C30 H31 N3 O9 -","- C120 H124 N12 O36 -","4","1","","Driller, Katrin Marie; Libnow, Stefanie; Hein, Martin; Harms, Manuela; Wende, Kristian; Lalk, Michael; Michalik, Dirk; Reinke, Helmut; Langer, Peter","Synthesis of 6H-indolo[2,3-b]quinoxaline-N-glycosides and their cytotoxic activity against human ceratinocytes (HaCaT)","Organic & Biomolecular Chemistry","2008","6","22","4218","4223","10.1039/b812308j","","","0.71073","MoKα","","0.0551","0.0484","","","0.1196","0.1243","","","","","","1.105","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151025","6.3601","0.0002","11.2214","0.0005","35.0578","0.0015","90","","90","","90","","2502.05","0.17","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","6-(2',3',4'-Tri-O-acetyl-β-L-rhamnopyranosyl)indolo[2,3-b]quinoxaline","","- C26 H25 N3 O7 -","- C26 H25 N3 O7 -","- C104 H100 N12 O28 -","4","1","","Driller, Katrin Marie; Libnow, Stefanie; Hein, Martin; Harms, Manuela; Wende, Kristian; Lalk, Michael; Michalik, Dirk; Reinke, Helmut; Langer, Peter","Synthesis of 6H-indolo[2,3-b]quinoxaline-N-glycosides and their cytotoxic activity against human ceratinocytes (HaCaT)","Organic & Biomolecular Chemistry","2008","6","22","4218","4223","10.1039/b812308j","","","0.71073","MoKα","","0.051","0.0359","","","0.0832","0.0904","","","","","","1.068","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151026","5.7683","0.0002","9.0468","0.0003","43.5087","0.0017","90","","90","","90","","2270.49","0.14","100","2","100","2","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H29 N O6 S -","- C24 H29 N O6 S -","- C96 H116 N4 O24 S4 -","4","1","","Paixão, Márcio W.; Nielsen, Martin; Jacobsen, Christian Borch; Jørgensen, Karl Anker","Organocatalytic asymmetric ring-opening of aziridines","Organic & Biomolecular Chemistry","2008","6","19","3467","3470","10.1039/B812369a","","x-ray","0.71073","MoKα","","0.0604","0.0514","","","0.1252","0.1296","","","","","","1.068","","","","has coordinates,has disorder","180296","2020-10-21","18:00:00",""
"7151027","6.589","0.003","7.55","0.003","9.691","0.004","97.609","0.006","103.781","0.006","106","0.006","439.8","0.3","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","","","- C12 H10 O2 -","- C12 H10 O2 -","- C24 H20 O4 -","2","1","","Ramachary, Dhevalapally B.; Reddy, Y. Vijayendar; Kishor, Mamillapalli","Multi-catalysis reactions: direct organocatalytic sequential one-pot synthesis of highly functionalized cyclopenta[b]chromen-1-ones","Organic & Biomolecular Chemistry","2008","6","22","4188","4197","10.1039/b812551a","","","0.71073","MoKα","","0.0476","0.0399","","","0.1052","0.1102","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151028","12.869","0.002","7.4613","0.0014","23.807","0.004","90","","90","","90","","2285.9","0.7","298","2","298","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C13 H14 O3 -","- C13 H14 O3 -","- C104 H112 O24 -","8","1","","Ramachary, Dhevalapally B.; Reddy, Y. Vijayendar; Kishor, Mamillapalli","Multi-catalysis reactions: direct organocatalytic sequential one-pot synthesis of highly functionalized cyclopenta[b]chromen-1-ones","Organic & Biomolecular Chemistry","2008","6","22","4188","4197","10.1039/b812551a","","","0.71073","MoKα","","0.0821","0.0639","","","0.141","0.1522","","","","","","1.137","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151029","10.828","0.004","11.7","0.004","15.348","0.005","75.228","0.007","74.785","0.008","73.428","0.007","1763.9","1.1","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C45 H40 Ge O2 -","- C45 H40 Ge O2 -","- C90 H80 Ge2 O4 -","2","1","","El Kettani, Sakina Ech-Cherif; Lazraq, Mohamed; Ouhsaine, Fatima; Gornitzka, Heinz; Ranaivonjatovo, Henri; Escudié, Jean","An unexpected epoxidation of benzil derivatives in their reaction with a germene","Organic & Biomolecular Chemistry","2008","6","21","4064","4066","10.1039/b812694c","","","0.71073","MoKα","","0.117","0.0558","","","0.093","0.1095","","","","","","0.903","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151030","7.042","0.003","18.432","0.002","15.5238","0.0013","90","","90","","90","","2015","0.9","193","2","193","2","","","","","","","","3","C 2 2 21","C 2c 2","20","Cyclopropane-1,2-dicarboxylic acid diethyl ester","","","- C9 H14 O4 -","- C9 H14 O4 -","- C72 H112 O32 -","8","1","","Riss, Patrick Johannes; Rösch, Frank","A convenient chemo-enzymatic synthesis and 18F-labelling of both enantiomers of trans-1-toluenesulfonyloxymethyl-2-fluoromethyl-cyclopropane","Organic & Biomolecular Chemistry","2008","6","24","4567","4574","10.1039/b812777h","","","1.54178","CuKα","","0.0665","0.0641","","","0.1708","0.1755","","","","","","1.048","","","","has coordinates,has disorder","180296","2020-10-21","18:00:00",""
"7151031","11.0147","0.0003","10.932","0.0003","14.7938","0.0004","90","","97.4949","0.0015","90","","1766.14","0.08","296.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C37 H41 N O6 S -","- C37 H41 N O6 S -","- C74 H82 N2 O12 S2 -","2","1","","Shibata, Takanori; Otomo, Mayumi; Tahara, Yu-ki; Endo, Kohei","Highly diastereo- and enantioselective construction of both central and axial chiralities by Rh-catalyzed [2 + 2 + 2] cycloaddition","Organic & Biomolecular Chemistry","2008","6","23","4296","4298","10.1039/b814014f","","","1.54187","CuKα","","","0.0432","","","","0.1059","","","","","","1.017","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151032","11.8532","0.0003","7.1565","0.0002","16.0428","0.0004","90","","102.421","0.001","90","","1329.02","0.06","150","2","150","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C13 H22 O4 -","- C13 H22 O4 -","- C52 H88 O16 -","4","1","","Butters, Michael; Beetstra, Dirk J.; Elliott, Mark C.; Hill-Cousins, Joseph; Kariuki, Benson M.","Directed epoxidation of cyclohexa-1,4-dienes‒stereoselective formation of up to six contiguous stereogenic centres","Organic & Biomolecular Chemistry","2008","6","23","4426","4434","10.1039/b814131m","","","0.71073","MoKα","","0.1026","0.0752","","","0.1923","0.213","","","","","","1.044","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151033","6.308","0.0002","13.542","0.0005","17.59","0.0007","73.293","0.002","81.756","0.002","79.108","0.002","1406.88","0.09","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C14 H24 O4 -","- C14 H24 O4 -","- C56 H96 O16 -","4","2","","Butters, Michael; Beetstra, Dirk J.; Elliott, Mark C.; Hill-Cousins, Joseph; Kariuki, Benson M.","Directed epoxidation of cyclohexa-1,4-dienes‒stereoselective formation of up to six contiguous stereogenic centres","Organic & Biomolecular Chemistry","2008","6","23","4426","4434","10.1039/b814131m","","","0.71073","MoKα","","0.1888","0.1401","","","0.3427","0.3752","","","","","","1.26","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151034","8.8975","0.0005","12.1847","0.0007","24.8677","0.0013","90","","90","","90","","2696","0.3","150","2","150","2","","","","","","","","3","P b c n","-P 2n 2ab","60","","","","- C18 H18 O -","- C18 H18 O -","- C144 H144 O8 -","8","1","","Iqbal, Mazhar; Duffy, Patricia; Evans, Paul; Cloughley, George; Allan, Bernard; Lledó, Agustí; Verdaguer, Xavier; Riera, Antoni","The conjugate addition‒Peterson olefination reaction for the preparation of cross-conjugated cyclopentenone, PPAR-γ ligands","Organic & Biomolecular Chemistry","2008","6","24","4649","4661","10.1039/b814619e","","","0.71073","MoKα","","0.0535","0.0477","","","0.1286","0.1339","","","","","","1.031","","","","has coordinates","180296","2020-10-21","18:00:00",""
"7151035","6.008","0.0011","17.848","0.002","30.989","0.004","90","","90","","90","","3323","0.8","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C36 H47 N O8 S -","- C36 H47 N O8 S -","- C144 H188 N4 O32 S4 -","4","1","","Chen, Qiao-Hong; Ganesh, Thota; Brodie, Peggy; Slebodnick, Carla; Jiang, Yi; Banerjee, Abhijit; Bane, Susan; Snyder, James P.; Kingston, David G. I.","Design, synthesis and biological evaluation of bridged epothilone D analogues","Organic & Biomolecular Chemistry","2008","6","24","4542","4552","10.1039/b814823f","","x-ray","1.54178","CuKα","","0.1304","0.0602","","","0.1229","0.1492","","","","","","0.804","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151036","34.899","0.007","9.3865","0.0019","7.5","0.0015","90","","90","","90","","2456.8","0.9","223","2","223","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C27 H46 O2 -","- C27 H46 O2 -","- C108 H184 O8 -","4","1","","Martin, René; Däbritz, Frank; Entchev, Eugeni V.; Kurzchalia, Teymuras V.; Knölker, Hans-Joachim","Stereoselective synthesis of the hormonally active (25S)-Δ7-dafachronic acid, (25S)-Δ4-dafachronic acid, (25S)-dafachronic acid, and (25S)-cholestenoic acid","Organic & Biomolecular Chemistry","2008","6","23","4293","4295","10.1039/b815064h","","","0.71073","MoKα","","0.0706","0.0468","","","0.1065","0.1172","","","","","","1.006","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151037","5.9247","0.0002","7.2417","0.0003","17.4475","0.0009","90","","90","","90","","748.58","0.06","150","","150","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(+)-2,5-dideoxy-2,5-imino-d-glucitol","","- C6 H13 N O4 -","- C6 H13 N O4 -","- C24 H52 N4 O16 -","4","1","","Donohoe, Timothy J.; Cheeseman, Matthew D.; O'Riordan, Timothy J. C.; Kershaw, Jessica A.","Synthesis of (+)-DGDP and (−)-7-epialexine","Organic & Biomolecular Chemistry","2008","6","21","3896","3898","10.1039/b815332a","","","0.71073","MoKα","","0.0548","0.0382","","0.0978","0.0911","0.0978","","","","","","0.9153","","","","has coordinates","202017","2020-10-21","18:00:00",""