# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-14T21:57:51+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 letters') AND volume = 7 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
"1506445","10.5953","0.0006","11.4554","0.0006","11.5796","0.0007","90","","108.903","0.001","90","","1329.66","0.13","200","2","200","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","19_in_paper?","","","- C24 H40 Br4 O2 -","- C24 H40 Br4 O2 -","- C48 H80 Br8 O4 -","2","0.5","","Werz, Daniel B.; Schuster, Andreea; Gleiter, Rolf; Rominger, Frank","Sterically stabilized cyclopropenonophanes and an electronically stabilized cyclopropenethionophane: syntheses, structural properties, and reactivity.","Organic letters","2005","7","5","917","920","10.1021/ol047317e","","","0.71073","MoKα","","0.0266","0.022","","","0.0525","0.0552","","","","","","1.095","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506446","40.0257","0.0006","7.4849","0.0002","15.0438","0.0003","90","","100.68","","90","","4428.88","0.16","200","2","200","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","6alpha_in_paper","","","- C24 H36 O2 -","- C24 H36 O2 -","- C192 H288 O16 -","8","2","","Werz, Daniel B.; Schuster, Andreea; Gleiter, Rolf; Rominger, Frank","Sterically stabilized cyclopropenonophanes and an electronically stabilized cyclopropenethionophane: syntheses, structural properties, and reactivity.","Organic letters","2005","7","5","917","920","10.1021/ol047317e","","","0.71073","MoKα","","0.1071","0.0636","","","0.1565","0.1811","","","","","","1.079","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506447","15.0286","0.0003","7.485","0.0002","39.3182","0.0008","90","","90","","90","","4422.87","0.17","200","2","200","2","","","","","","","","3","P n a 21","P 2c -2n","33","6beta_in_paper","","","- C24 H36 O2 -","- C24 H36 O2 -","- C192 H288 O16 -","8","2","","Werz, Daniel B.; Schuster, Andreea; Gleiter, Rolf; Rominger, Frank","Sterically stabilized cyclopropenonophanes and an electronically stabilized cyclopropenethionophane: syntheses, structural properties, and reactivity.","Organic letters","2005","7","5","917","920","10.1021/ol047317e","","","0.71073","MoKα","","0.0419","0.0341","","","0.0825","0.0877","","","","","","1.04","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506448","9.0844","0.0003","11.8406","0.0003","9.8502","0.0003","90","","113.063","0.001","90","","974.85","0.05","200","2","200","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","7alpha_in_paper","","","- C16 H20 S6 -","- C16 H20 S6 -","- C32 H40 S12 -","2","0.5","","Werz, Daniel B.; Schuster, Andreea; Gleiter, Rolf; Rominger, Frank","Sterically stabilized cyclopropenonophanes and an electronically stabilized cyclopropenethionophane: syntheses, structural properties, and reactivity.","Organic letters","2005","7","5","917","920","10.1021/ol047317e","","","0.71073","MoKα","","0.0471","0.0313","","","0.0736","0.0794","","","","","","1.065","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506449","9.4288","0.0003","10.8171","0.0003","11.4266","0.0004","107.53","0.001","113.144","0.001","98.332","0.001","974.7","0.06","200","2","200","2","","","","","","","","3","P -1","-P 1","2","7beta_in_paper","","","- C16 H20 S6 -","- C16 H20 S6 -","- C32 H40 S12 -","2","1","","Werz, Daniel B.; Schuster, Andreea; Gleiter, Rolf; Rominger, Frank","Sterically stabilized cyclopropenonophanes and an electronically stabilized cyclopropenethionophane: syntheses, structural properties, and reactivity.","Organic letters","2005","7","5","917","920","10.1021/ol047317e","","","0.71073","MoKα","","0.0462","0.0339","","","0.0823","0.0886","","","","","","1.037","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506450","10.2496","0.0011","6.7971","0.0007","10.6545","0.0011","90","","90","","90","","742.27","0.13","200","2","200","2","","","","","","","","3","P n m a","-P 2ac 2n","62","22_in_paper","","","- C5 H6 S3 -","- C5 H6 S3 -","- C20 H24 S12 -","4","0.5","","Werz, Daniel B.; Schuster, Andreea; Gleiter, Rolf; Rominger, Frank","Sterically stabilized cyclopropenonophanes and an electronically stabilized cyclopropenethionophane: syntheses, structural properties, and reactivity.","Organic letters","2005","7","5","917","920","10.1021/ol047317e","","","0.71073","MoKα","","0.0392","0.0244","","","0.0536","0.058","","","","","","1.121","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506451","17.2213","0.0007","7.005","0.0003","11.4894","0.0005","90","","90","","90","","1386.03","0.1","200","2","200","2","","","","","","","","5","P n m a","-P 2ac 2n","62","23alpha_in_paper","","","- C7 H11 Cl2 I S3 -","- C7 H10.608 Cl1.998 I S3 -","- C28 H42.432 Cl7.992 I4 S12 -","4","0.5","","Werz, Daniel B.; Schuster, Andreea; Gleiter, Rolf; Rominger, Frank","Sterically stabilized cyclopropenonophanes and an electronically stabilized cyclopropenethionophane: syntheses, structural properties, and reactivity.","Organic letters","2005","7","5","917","920","10.1021/ol047317e","","","0.71073","MoKα","","0.0479","0.0301","","","0.0596","0.0649","","","","","","1.058","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506452","6.5122","0.0004","7.7517","0.0005","11.2286","0.0008","74.596","0.002","83.282","0.002","74.962","0.002","527.05","0.06","200","2","200","2","","","","","","","","4","P -1","-P 1","2","23beta_in_paper","","","- C6 H9 I S3 -","- C6 H9 I S3 -","- C12 H18 I2 S6 -","2","1","","Werz, Daniel B.; Schuster, Andreea; Gleiter, Rolf; Rominger, Frank","Sterically stabilized cyclopropenonophanes and an electronically stabilized cyclopropenethionophane: syntheses, structural properties, and reactivity.","Organic letters","2005","7","5","917","920","10.1021/ol047317e","","","0.71073","MoKα","","0.0445","0.0288","","","0.0501","0.0539","","","","","","1.005","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506453","9.6693","0.0005","14.1562","0.0003","10.6917","0.0005","90","","104.057","0.002","90","","1419.66","0.1","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","24_in_paper","","","- C6 H9 I3 S3 -","- C6 H9 I3 S3 -","- C24 H36 I12 S12 -","4","1","","Werz, Daniel B.; Schuster, Andreea; Gleiter, Rolf; Rominger, Frank","Sterically stabilized cyclopropenonophanes and an electronically stabilized cyclopropenethionophane: syntheses, structural properties, and reactivity.","Organic letters","2005","7","5","917","920","10.1021/ol047317e","","","0.71073","MoKα","","0.0516","0.0331","","","0.0813","0.0878","","","","","","1.129","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506454","9.2385","0.0002","12.0517","0.0003","16.415","0.0005","90","","90","","90","","1827.64","0.08","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C16 H19 F6 N2 P Ru -","- C16 H17 F6 N2 P Ru -","- C64 H68 F24 N8 P4 Ru4 -","4","1","","Sortais, Jean-Baptiste; Ritleng, Vincent; Voelklin, Adeline; Holuigue, Alexandre; Smail, Hakima; Barloy, Laurent; Sirlin, Claude; Verzijl, Gerard K. M.; Boogers, Jeroen A. F.; de Vries, André H M; de Vries, Johannes G.; Pfeffer, Michel","Cycloruthenated primary and secondary amines as efficient catalyst precursors for asymmetric transfer hydrogenation.","Organic letters","2005","7","7","1247","1250","10.1021/ol047353d","","","0.71073","Mo-Kα","","0.071","0.036","","0.123","","0.044","","","3.376","","","1.066","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1506455","19.327","0.009","19.327","0.009","9.814","0.006","90","","90","","90","","3666","3","293","2","293","2","","","","","","","","3","I 4","I 4","79","","","","- C20 H22 O6 -","- C20 H22 O6 -","- C160 H176 O48 -","8","1","","Saouf, Abderrahmane; Guerra, Francisco M.; Rubal, Juan J.; Moreno-Dorado, F Javier; Akssira, Mohamed; Mellouki, Fouad; López, Matías; Pujadas, Antonio J.; Jorge, Zacarías D; Massanet, Guillermo M.","Transtaganolides A-D: novel metabolites from Thapsia transtagana.","Organic letters","2005","7","5","881","884","10.1021/ol047421w","","","0.71073","MoKα","","0.0741","0.0575","","","0.1348","0.1435","","","","","","1.044","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506456","10.052","0.004","10.322","0.004","17.378","0.009","90","","90","","90","","1803.1","1.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H22 O6 -","- C20 H22 O6 -","- C80 H88 O24 -","4","1","","Saouf, Abderrahmane; Guerra, Francisco M.; Rubal, Juan J.; Moreno-Dorado, F Javier; Akssira, Mohamed; Mellouki, Fouad; López, Matías; Pujadas, Antonio J.; Jorge, Zacarías D; Massanet, Guillermo M.","Transtaganolides A-D: novel metabolites from Thapsia transtagana.","Organic letters","2005","7","5","881","884","10.1021/ol047421w","","","0.71073","MoKα","","0.0605","0.0553","","","0.1338","0.1377","","","","","","1.139","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506457","10.373","","10.925","","14.066","","83.18","","70.88","","78.91","","1475.3","","293","2","293","2","","","","","","","synthesis as described","4","P -1","-P 1","2","","","","- C32 H38 N2 O8 -","- C32 H38 N2 O8 -","- C64 H76 N4 O16 -","2","1","","Frontera, Antonio; Orell, Maria; Garau, Carolina; Quiñonero, David; Molins, Elies; Mata, Ignasi; Morey, Jeroni","Preparation, solid-state characterization, and computational study of a crown ether attached to a squaramide.","Organic letters","2005","7","8","1437","1440","10.1021/ol0474608","","x-ray","0.71073","MoKα","","0.2549","0.0492","","","0.1173","0.1673","","","","","","0.924","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506458","7.574","0.006","27.38","0.02","15.555","0.014","90","","104.028","0.014","90","","3130","4","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Cyclo-bis(3-glycolyloxycholate)","","- C52 H80 O12 -","- C52 H79 O12 -","- C104 H158 O24 -","2","1","","Ghosh, Sanjib; Choudhury, Angshuman Roy; Guru Row, Tayur N.; Maitra, Uday","Selective and unusual fluoride ion complexation by a steroidal receptor using OH...F- and CH...F- interactions: a new motif for anion coordination?","Organic letters","2005","7","8","1441","1444","10.1021/ol047462s","","","0.71073","MoKα","","0.087","0.0693","","","0.2081","0.2198","","","","","","1.086","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506459","11.529","0.01","16.683","0.014","12.782","0.011","90","","98.895","0.015","90","","2429","4","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","Cyclo-bis(3-glycolyloxycholate)","","- C52 H80 O12 -","- C52 H79 O12 -","- C104 H158 O24 -","2","1","","Ghosh, Sanjib; Choudhury, Angshuman Roy; Guru Row, Tayur N.; Maitra, Uday","Selective and unusual fluoride ion complexation by a steroidal receptor using OH...F- and CH...F- interactions: a new motif for anion coordination?","Organic letters","2005","7","8","1441","1444","10.1021/ol047462s","","","0.71073","MoKα","","0.1313","0.0818","","","0.2119","0.2331","","","","","","1.022","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506460","9.0221","0.0009","12.5961","0.0012","16.13","0.0016","83.714","0.002","79.252","0.002","84.161","0.002","1783.9","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H22 N2 O6 -","- C17 H22 N2 O6 -","- C68 H88 N8 O24 -","4","2","","Otte, Ryan D.; Sakata, Tomoyo; Guzei, Ilia A.; Lee, Daesung","Reactivity of Mitsunobu reagent toward carbonyl compounds.","Organic letters","2005","7","3","495","498","10.1021/ol0475008","","","0.71073","MoKα","","0.0566","0.0483","","","0.1203","0.1258","","","","","","1.013","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506461","11.35","0.001","11.4769","0.001","14.7702","0.0013","90","","90","","90","","1924","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H28 N2 O6 -","- C18 H28 N2 O6 -","- C72 H112 N8 O24 -","4","1","","Otte, Ryan D.; Sakata, Tomoyo; Guzei, Ilia A.; Lee, Daesung","Reactivity of Mitsunobu reagent toward carbonyl compounds.","Organic letters","2005","7","3","495","498","10.1021/ol0475008","","","0.71073","MoKα","","0.0642","0.0632","","","0.1768","0.178","","","","","","1.055","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506462","8.1348","0.001","13.1474","0.0017","20.118","0.003","101.643","0.002","99.396","0.002","98.559","0.002","2042","0.5","100","2","100","2","","","","","","","","3","P -1","-P 1","2","04236c","","","- C40 H20 F24 -","- C40 H20 F24 -","- C80 H40 F48 -","2","1","","Liu, Jin; Wendt, Natalie L.; Boarman, Kelly J.","Trifluoromethyl groups in crystal design of 1,4-diphenyl-1,3-butadienes for topochemical [2 + 2] photodimerization.","Organic letters","2005","7","6","1007","1010","10.1021/ol0475111","","","0.71073","MoKα","","0.066","0.0489","","","0.1357","0.1464","","","","","","1.051","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506463","4.8166","0.0012","11.259","0.003","16.773","0.004","90","","94.405","0.004","90","","906.9","0.4","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","04237b","","","- C20 H10 F12 -","- C20 H10 F12 -","- C40 H20 F24 -","2","0.5","","Liu, Jin; Wendt, Natalie L.; Boarman, Kelly J.","Trifluoromethyl groups in crystal design of 1,4-diphenyl-1,3-butadienes for topochemical [2 + 2] photodimerization.","Organic letters","2005","7","6","1007","1010","10.1021/ol0475111","","","0.71073","MoKα","","0.0545","0.0445","","","0.1222","0.1325","","","","","","1.051","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506464","7.9641","0.0008","11.8791","0.0012","16.6095","0.0017","92.391","0.002","99.039","0.002","94.984","0.002","1543.5","0.3","100","2","100","2","","","","","","","","3","P -1","-P 1","2","04255a","","","- C36 H20 F16 -","- C36 H20 F16 -","- C72 H40 F32 -","2","1","","Liu, Jin; Wendt, Natalie L.; Boarman, Kelly J.","Trifluoromethyl groups in crystal design of 1,4-diphenyl-1,3-butadienes for topochemical [2 + 2] photodimerization.","Organic letters","2005","7","6","1007","1010","10.1021/ol0475111","","","0.71073","MoKα","","0.0602","0.0387","","","0.0915","0.1029","","","","","","1.022","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506465","4.7834","0.0009","7.7026","0.0015","11.29","0.002","104.706","0.002","97.67","0.002","104.072","0.002","381.74","0.12","100","2","100","2","","","","","","","","3","P -1","-P 1","2","04256a","","","- C18 H10 F8 -","- C18 H10 F8 -","- C18 H10 F8 -","1","0.5","","Liu, Jin; Wendt, Natalie L.; Boarman, Kelly J.","Trifluoromethyl groups in crystal design of 1,4-diphenyl-1,3-butadienes for topochemical [2 + 2] photodimerization.","Organic letters","2005","7","6","1007","1010","10.1021/ol0475111","","","0.71073","MoKα","","0.0438","0.0351","","","0.0904","0.0966","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506466","6.4992","0.0001","14.9706","0.0004","34.8326","0.0006","90","","90","","90","","3389.1","0.12","150","","","","","","","","","","Local laboratory","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H17 N O4 S -","- C19 H17 N O4 S -","- C152 H136 N8 O32 S8 -","8","2","","Pemberton, Nils; Emtenäs, Hans; Boström, Dan; Domaille, Peter J.; Greenberg, William A.; Levin, Michael D.; Zhu, Zuolin; Almqvist, Fredrik","Cycloaddition of delta2-thiazolines and acyl ketenes under acidic conditions results in bicyclic 1,3-oxazinones and not 6-acylpenams as earlier reported.","Organic letters","2005","7","6","1019","1021","10.1021/ol047528j","","","0.71073","MoKα","","0.0665","0.0567","","","0.1444","0.1601","","","","","","1.198","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506467","7.488","0.001","8.724","0.001","11.424","0.002","98.55","0.01","103","0.01","105.39","0.01","683.61","0.18","103.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H15 N O3 -","- C17 H15 N O3 -","- C34 H30 N2 O6 -","2","1","","Ishikawa, Teruhiko; Miyahara, Tadashi; Asakura, Mami; Higuchi, Shuichi; Miyauchi, Yayoi; Saito, Seiki","One-pot multistep synthesis of 4-acetoxy-2-amino-3-arylbenzofurans from 1-aryl-2-nitroethylenes and cyclohexane-1,3-diones.","Organic letters","2005","7","7","1211","1214","10.1021/ol047540b","","","1.5419","CuKα","","","0.068","","","","0.067","","","","","","12.989","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506468","7.57","0.02","9.27","0.02","11.24","0.03","107.1","0.1","102","0.1","99.6","0.1","715","3","296.1","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H15 N O4 -","- C17 H15 N O4 -","- C34 H30 N2 O8 -","2","1","","Ishikawa, Teruhiko; Miyahara, Tadashi; Asakura, Mami; Higuchi, Shuichi; Miyauchi, Yayoi; Saito, Seiki","One-pot multistep synthesis of 4-acetoxy-2-amino-3-arylbenzofurans from 1-aryl-2-nitroethylenes and cyclohexane-1,3-diones.","Organic letters","2005","7","7","1211","1214","10.1021/ol047540b","","","1.5419","CuKα","","","0.039","","","","0.037","","","","","","1.812","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506469","9.0452","0.0012","10.6117","0.0018","11.2674","0.0018","67.639","0.012","79.657","0.013","84.959","0.013","983.7","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H20 O4 -","- C24 H20 O4 -","- C48 H40 O8 -","2","1","","Xi, Chanjuan; Chen, Chao; Lin, Jie; Hong, Xiaoyin","Pd-catalyzed one-pot multicomponent coupling reaction for the highly regioselective synthesis of polysubstituted benzenes.","Organic letters","2005","7","2","347","349","10.1021/ol047553p","","","0.71073","MoKα","","0.0574","0.0415","","","0.0808","0.0893","","","","","","1.034","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506470","8.5238","0.0005","15.83","0.002","16.8","0.002","90.003","0.003","90.0048","0.0009","90.098","0.001","2266.9","0.4","296.2","","","","","","","","","","","5","P -1","-P 1","2","","","","- C25 H27 N O3 S -","- C25 H27 N O3 S -","- C100 H108 N4 O12 S4 -","4","2","","Shimizu, Masamichi; Kimura, Masanari; Watanabe, Toshiya; Tamaru, Yoshinao","Palladium-catalyzed allylation of imines with allyl alcohols.","Organic letters","2005","7","4","637","640","10.1021/ol047609f","","","0.7107","MoKα","","","0.0472","","","","0.1212","","","","","","0.886","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506471","9.86","0.004","12.3513","0.0018","13.171","0.002","100.789","0.013","103.509","0.019","103.5","0.02","1466.1","0.7","193","2","193","2","","","","","","","","4","P -1","-P 1","2","","","","- C31 H37 N3 O9 -","- C31 H37 N3 O9 -","- C62 H74 N6 O18 -","2","1","","Rudzevich, Yuliya; Rudzevich, Valentyn; Schollmeyer, Dieter; Thondorf, Iris; Böhmer, Volker","Hydrogen bonded dimers of triurea derivatives of triphenylmethanes.","Organic letters","2005","7","4","613","616","10.1021/ol0476265","","","1.54178","CuKα","","0.0814","0.0757","","","0.1977","0.205","","","","","","1.059","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506472","8.792","0.004","14.257","0.007","19.081","0.009","90","","95.562","0.01","90","","2380.5","1.9","110","2","110","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C36 H28 -","- C36 H26 -","- C144 H104 -","4","1","","Wang, Huadong; Gabbaï, François P","Synthesis and reactivity of a chlorinated 1,8-bis(diarylmethylium)naphthalenediyl dication.","Organic letters","2005","7","2","283","285","10.1021/ol0477071","","","0.71073","MoKα","","0.0701","0.0409","","","0.066","0.071","","","","","","0.961","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506473","12.311","0.002","18.239","0.003","13.189","0.002","90","","110.616","0.002","90","","2771.8","0.8","110","2","110","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C36 H22 Cl4 -","- C36 H22 Cl4 -","- C144 H88 Cl16 -","4","1","","Wang, Huadong; Gabbaï, François P","Synthesis and reactivity of a chlorinated 1,8-bis(diarylmethylium)naphthalenediyl dication.","Organic letters","2005","7","2","283","285","10.1021/ol0477071","","","0.71073","MoKα","","0.0546","0.0498","","","0.141","0.1479","","","","","","1.002","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506474","12.1408","0.0019","18.163","0.003","13.577","0.002","90","","107.848","0.003","90","","2849.8","0.8","110","2","110","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C36 H21 Cl5 -","- C36 H21 Cl5 -","- C144 H84 Cl20 -","4","1","","Wang, Huadong; Gabbaï, François P","Synthesis and reactivity of a chlorinated 1,8-bis(diarylmethylium)naphthalenediyl dication.","Organic letters","2005","7","2","283","285","10.1021/ol0477071","","","0.71073","MoKα","","0.0786","0.0472","","","0.101","0.1097","","","","","","1.008","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506475","16.92","0.001","6.444","0.001","11.27","0.001","90","","92.45","0.01","90","","1227.7","0.2","293","2","293","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C13 H12 Br2 O2 -","- C13 H12 Br2 O2 -","- C52 H48 Br8 O8 -","4","1","","Pelphrey, Phillip; Jasinski, Jerry; Butcher, Ray J.; Wright, Dennis L.","Oxabicyclo[3.2.1]octane derivatives as highly reactive dienophiles: synthesis of bicyclo[5.n.0] systems.","Organic letters","2005","7","3","423","425","10.1021/ol047725i","","","0.71073","MoKα","","0.062","0.0596","","","0.1672","0.17","","","","","","1.083","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506476","10.3322","0.0004","11.1219","0.0006","19.0191","0.0011","90","","90","","90","","2185.56","0.19","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C11 H8 Br2 O3 -","- C11 H8 Br2 O3 -","- C88 H64 Br16 O24 -","8","1","","Pelphrey, Phillip; Jasinski, Jerry; Butcher, Ray J.; Wright, Dennis L.","Oxabicyclo[3.2.1]octane derivatives as highly reactive dienophiles: synthesis of bicyclo[5.n.0] systems.","Organic letters","2005","7","3","423","425","10.1021/ol047725i","","","1.54178","CuKα","","0.0627","0.0576","","","0.1643","0.1722","","","","","","1.071","","","","has coordinates","194547","2020-10-21","18:00:00",""
"1506477","8.2559","0.0005","6.0132","0.0004","38.196","0.003","90","","93.358","0.002","90","","1893","0.2","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H22 N4 O4 -","- C20 H22 N4 O4 -","- C80 H88 N16 O16 -","4","1","","Hong, Bor-Cherng; Chen, Fon-Len; Chen, Shang-Hung; Liao, Ju-Hsiou; Lee, Gene-Hsiang","Intramolecular Diels-Alder cycloadditions of fulvenes. Application to the kigelinol, neoamphilectane, and kempane skeletons.","Organic letters","2005","7","4","557","560","10.1021/ol047730m","","","0.71073","MoKα","","0.1305","0.0911","","","0.1978","0.2241","","","","","","1.193","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506478","9.795","0.001","12.533","0.002","15.01","0.002","90","","106.89","0.01","90","","1763.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 N4 O4 -","- C19 H19 N4 O4 -","- C76 H76 N16 O16 -","4","1","","Hong, Bor-Cherng; Chen, Fon-Len; Chen, Shang-Hung; Liao, Ju-Hsiou; Lee, Gene-Hsiang","Intramolecular Diels-Alder cycloadditions of fulvenes. Application to the kigelinol, neoamphilectane, and kempane skeletons.","Organic letters","2005","7","4","557","560","10.1021/ol047730m","","","0.71073","MoKα","","0.121","0.0719","","","0.1887","0.2275","","","","","","0.94","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506479","11.6349","0.0011","9.5265","0.0008","14.2117","0.0012","90","","112.492","0.002","90","","1455.4","0.2","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H22 O2 -","- C17 H22 O2 -","- C68 H88 O8 -","4","1","","Hong, Bor-Cherng; Chen, Fon-Len; Chen, Shang-Hung; Liao, Ju-Hsiou; Lee, Gene-Hsiang","Intramolecular Diels-Alder cycloadditions of fulvenes. Application to the kigelinol, neoamphilectane, and kempane skeletons.","Organic letters","2005","7","4","557","560","10.1021/ol047730m","","","0.71073","MoKα","","0.114","0.0718","","","0.1781","0.2077","","","","","","1","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506480","10.24","0.0007","9.3818","0.0007","21.2499","0.0015","90","","97.066","0.001","90","","2026","0.3","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 N O6 S -","- C20 H23 N O6 S -","- C80 H92 N4 O24 S4 -","4","1","","Bendikov, Michael; Duong, Hieu M.; Bolanos, Eduardo; Wudl, Fred","An unexpected two-group migration involving a sulfonynamide to nitrile rearrangement. Mechanistic studies of a thermal N ‒> C tosyl rearrangement.","Organic letters","2005","7","5","783","786","10.1021/ol0477327","","","0.71073","MoKα","","0.0465","0.0348","","","0.0874","0.0929","","","","","","1.042","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506481","17.026","0.003","8.4434","0.0014","14.299","0.002","90","","104.242","0.003","90","","1992.4","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N O5 S -","- C20 H21 N O5 S -","- C80 H84 N4 O20 S4 -","4","1","","Bendikov, Michael; Duong, Hieu M.; Bolanos, Eduardo; Wudl, Fred","An unexpected two-group migration involving a sulfonynamide to nitrile rearrangement. Mechanistic studies of a thermal N ‒> C tosyl rearrangement.","Organic letters","2005","7","5","783","786","10.1021/ol0477327","","","0.71073","MoKα","","0.1371","0.0429","","","0.0874","0.1082","","","","","","0.821","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506482","7.8726","0.0013","8.0401","0.0013","17.08","0.003","82.933","0.003","81.248","0.003","69.356","0.003","997.1","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H21 N O5 S -","- C20 H21 N O5 S -","- C40 H42 N2 O10 S2 -","2","1","","Bendikov, Michael; Duong, Hieu M.; Bolanos, Eduardo; Wudl, Fred","An unexpected two-group migration involving a sulfonynamide to nitrile rearrangement. Mechanistic studies of a thermal N ‒> C tosyl rearrangement.","Organic letters","2005","7","5","783","786","10.1021/ol0477327","","","0.71073","MoKα","","0.0782","0.0456","","","0.1175","0.1411","","","","","","1.006","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506483","12.0167","0.0016","13.6419","0.0019","29.948","0.004","90","","90","","90","","4909.4","1.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C27 H40 O3 -","- C27 H40 O3 -","- C216 H320 O24 -","8","2","","Zhang, Guang-Wen; Ma, Xiang-Quan; Kurihara, Hiroshi; Zhang, Cui-Xian; Yao, Xin-Sheng; Su, Jing-Yu; Zeng, Long-Mei","New hemiketal steroid from the soft coral Cladiella sp.","Organic letters","2005","7","6","991","994","10.1021/ol0477475","","","0.71073","MoKα","","0.057","0.0456","","","0.12","0.1299","","","","","","1.035","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506484","9.8972","0.0004","12.4672","0.0005","21.6365","0.0008","90","","90","","90","","2669.74","0.18","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H30 N2 O3 -","- C31 H30 N2 O3 -","- C124 H120 N8 O12 -","4","1","","Wipf, Peter; Xiao, Jingbo","Convergent approach to (E)-alkene and cyclopropane peptide isosteres.","Organic letters","2005","7","1","103","106","10.1021/ol0477529","","","0.71073","MoKα","","0.1328","0.0935","","","0.1546","0.169","","","","","","1.134","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506485","11.1945","0.0016","9.697","0.0015","26.431","0.004","90","","94.007","0.004","90","","2862.2","0.7","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C31 H36 N3 O5 -","- C31 H36 N3 O5 -","- C124 H144 N12 O20 -","4","2","","Wipf, Peter; Xiao, Jingbo","Convergent approach to (E)-alkene and cyclopropane peptide isosteres.","Organic letters","2005","7","1","103","106","10.1021/ol0477529","","","0.71073","MoKα","","0.3045","0.1006","","","0.1723","0.2372","","","","","","0.758","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506486","14.434","0.006","16.772","0.007","15.101","0.006","90","","104.301","0.007","90","","3542","3","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C35 H38 N2 O5 Si -","- C35 H38 N2 O5 Si -","- C140 H152 N8 O20 Si4 -","4","1","","Wipf, Peter; Xiao, Jingbo","Convergent approach to (E)-alkene and cyclopropane peptide isosteres.","Organic letters","2005","7","1","103","106","10.1021/ol0477529","","","0.71073","MoKα","","0.1063","0.0654","","","0.1461","0.1632","","","","","","1.103","","","","has coordinates","194547","2020-10-21","18:00:00",""
"1506487","8.2041","0.0007","8.0433","0.0007","12.2666","0.001","90","","102.129","0.001","90","","791.38","0.12","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H7 N O2 S -","- C8 H7 N O2 S -","- C32 H28 N4 O8 S4 -","4","1","","Harmata, Michael; Rayanil, Kanok-On; Gomes, Maria G.; Zheng, Pinguan; Calkins, Nathan L.; Kim, Soo-Yeun; Fan, Yimin; Bumbu, Valentina; Lee, Dong Reyoul; Wacharasindhu, Sumrit; Hong, Xuechuan","New synthesis of benzothiazines and benzoisothiazoles containing a sulfoximine functional group.","Organic letters","2005","7","1","143","145","10.1021/ol047781j","","","0.71073","MoKα","","0.0426","0.0354","","","0.0884","0.0923","","","","","","1.052","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506488","15.8947","0.0012","7.1605","0.0006","17.1209","0.0013","90","","100.848","0.002","90","","1913.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 N5 O3 -","- C20 H19 N5 O3 -","- C80 H76 N20 O12 -","4","1","","Cardillo, Giuliana; Fabbroni, Serena; Gentilucci, Luca; Perciaccante, Rossana; Piccinelli, Fabio; Tolomelli, Alessandra","Highly diastereoselective allylic azide formation and isomerization. Synthesis of 3(2'-amino)-beta-lactams.","Organic letters","2005","7","4","533","536","10.1021/ol047815n","","","0.71073","MoKα","","0.0676","0.0435","","","0.1143","0.1297","","","","","","1.037","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506489","7.338","0.007","15.567","0.017","23.86","0.02","90","","90","","90","","2726","5","","","295","2","","","","","","","","3","C 2 2 21","C 2c 2","20","","","","- C15 H20 O3 -","- C15 H20 O3 -","- C120 H160 O24 -","8","1","","Jeffery, David W.; Perkins, Michael V.; White, Jonathan M.","Synthesis of an analogue of the marine polypropionate tridachiahydropyrone.","Organic letters","2005","7","3","407","409","10.1021/ol0478178","","","0.71073","MoKα","","0.2614","0.1136","","","0.2152","0.2849","","","","","","0.93","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506490","7.638","0.0011","8.2565","0.0012","11.3453","0.0016","90","","95.765","0.003","90","","711.85","0.18","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C15 H20 O3 -","- C15 H20 O3 -","- C30 H40 O6 -","2","1","","Jeffery, David W.; Perkins, Michael V.; White, Jonathan M.","Synthesis of an analogue of the marine polypropionate tridachiahydropyrone.","Organic letters","2005","7","3","407","409","10.1021/ol0478178","","","0.71073","MoKα","","0.062","0.0532","","","0.1324","0.138","","","","","","0.975","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506491","8.2443","0.0005","16.1149","0.0007","15.7912","0.0007","90","","90","","90","","2097.96","0.18","148","","148","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(3R)-3-Methyl-N-[(((1R,2S)-2-(1-methyl-1-phenylethyl)cyclohexyl)oxy)carbonyl) -2,3-dihydro-isoindol-1-one","","- C25 H29 N O3 -","- C25 H29 N O3 -","- C100 H116 N4 O12 -","4","1","","Comins, Daniel L.; Schilling, Stefan; Zhang, Yanchen","Asymmetric synthesis of 3-substituted isoindolinones: application to the total synthesis of (+)-lennoxamine.","Organic letters","2005","7","1","95","98","10.1021/ol047824w","","","0.71073","MolybdenumKα","","0.031","0.031","","0.033","","0.033","","","","","","1.26","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506492","7.9727","0.0008","12.991","0.0013","15.0747","0.0015","90","","90","","90","","1561.3","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H19 Br O3 -","- C13 H19 Br O3 -","- C52 H76 Br4 O12 -","4","1","","Vaz, Belén; Alvarez, Rosana; Brückner, Reinhard; de Lera, Angel R.","The Stille reaction in the synthesis of carotenoid butenolides: synthesis of 6'-epi-peridinin.","Organic letters","2005","7","4","545","548","10.1021/ol0478281","","","0.71073","MoKα","","0.1335","0.0463","","","0.1053","0.1223","","","","","","0.783","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506493","10.2154","0.0008","21.8191","0.0017","11.5734","0.0009","90","","106.447","0.002","90","","2474.1","0.3","173","2","173","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H29 N O5 S2 -","- C24 H29 N O5 S2 -","- C96 H116 N4 O20 S8 -","4","2","","Vaz, Belén; Alvarez, Rosana; Brückner, Reinhard; de Lera, Angel R.","The Stille reaction in the synthesis of carotenoid butenolides: synthesis of 6'-epi-peridinin.","Organic letters","2005","7","4","545","548","10.1021/ol0478281","","","0.71073","MoKα","","0.06","0.04","","","0.0652","0.0695","","","","","","0.862","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506494","8.0985","0.0012","10.4719","0.0016","12.3827","0.0019","90","","90.47","0.003","90","","1050.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C8 H8 Br I O3 -","- C8 H8 Br I O3 -","- C32 H32 Br4 I4 O12 -","4","1","","Vaz, Belén; Alvarez, Rosana; Brückner, Reinhard; de Lera, Angel R.","The Stille reaction in the synthesis of carotenoid butenolides: synthesis of 6'-epi-peridinin.","Organic letters","2005","7","4","545","548","10.1021/ol0478281","","","0.71073","MoKα","","0.0744","0.0566","","","0.1536","0.1609","","","","","","0.996","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506495","12.7957","0.0001","18.2036","0.0002","33.0523","0.0005","90","","90","","90","","7698.8","0.16","173","2","173","2","","","","","","","","4","P c 21 b","P -2bc -2c","29","","","","- C48 H100 B40 Si5 -","- C48 H100 B40 Si5 -","- C192 H400 B160 Si20 -","4","1","","Núñez, Rosario; González, Arántzazu; Viñas, Clara; Teixidor, Francesc; Sillanpää, Reijo; Kivekäs, Raikko","Approaches to the preparation of carborane-containing carbosilane compounds.","Organic letters","2005","7","2","231","233","10.1021/ol0478335","","x-ray","0.71073","Mokα","","0.1062","0.0674","","","0.1028","0.1153","","","","","","1.051","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506496","12.3501","0.0014","18.786","0.002","10.827","0.0012","90","","90","","90","","2512","0.5","298","2","298","2","","","","","","","","4","P c a 21","P 2c -2ac","29","compound 3b","11,23-dimethyl-4,6,16,18-tetranitro-2,8,14,20-tetraoxacalix[4]arene","","- C26 H16 N4 O12 -","- C26 H16 N4 O12 -","- C104 H64 N16 O48 -","4","1","","Katz, Jeffrey L.; Feldman, Michael B.; Conry, Rebecca R.","Synthesis of functionalized oxacalix[4]arenes.","Organic letters","2005","7","1","91","94","10.1021/ol047840t","","","0.71073","MoKα","","0.1187","0.0711","","","0.1404","0.1702","","","","","","0.962","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506497","17.22","0.002","8.4231","0.001","21.729","0.003","90","","110.017","0.002","90","","2961.3","0.6","298","2","298","2","","","","","","","","4","P 1 n 1","P -2yac","7","compound 3e","26,28-dihydroxy-4,6,16,18-tetranitro-2,8,14,20-tetraoxacalix[4]arene","","- C28 H18 N6 O14 -","- C28 H18 N6 O14 -","- C112 H72 N24 O56 -","4","2","","Katz, Jeffrey L.; Feldman, Michael B.; Conry, Rebecca R.","Synthesis of functionalized oxacalix[4]arenes.","Organic letters","2005","7","1","91","94","10.1021/ol047840t","","","0.71073","MoKα","","0.0825","0.0523","","","0.1266","0.147","","","","","","0.92","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506498","8.245","0.002","9.07","0.002","15.501","0.004","93.34","0.02","91.41","0.02","110.26","0.02","1084.4","0.5","299","2","299","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H20 N2 O8 -","- C23 H20 N2 O8 -","- C46 H40 N4 O16 -","2","1","","Lu, Chong-Dao; Liu, Hui; Chen, Zhi-Yong; Hu, Wen-Hao; Mi, Ai-Qiao","Three-component reaction of aryl diazoacetates, alcohols, and aldehydes (or imines): evidence of alcoholic oxonium ylide intermediates.","Organic letters","2005","7","1","83","86","10.1021/ol0478483","","","0.71073","MoKα","","0.0631","0.0404","","","0.1073","0.1137","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506499","9.058","0.0015","10.3496","0.0018","14.987","0.003","74.357","0.003","78.955","0.003","86.161","0.003","1327.7","0.4","294","2","294","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H28 N2 O7 -","- C30 H28 N2 O7 -","- C60 H56 N4 O14 -","2","1","","Lu, Chong-Dao; Liu, Hui; Chen, Zhi-Yong; Hu, Wen-Hao; Mi, Ai-Qiao","Three-component reaction of aryl diazoacetates, alcohols, and aldehydes (or imines): evidence of alcoholic oxonium ylide intermediates.","Organic letters","2005","7","1","83","86","10.1021/ol0478483","","","0.71073","MoKα","","0.0662","0.0484","","","0.1219","0.1357","","","","","","1.019","","","","has coordinates","198632","2020-10-21","18:00:00",""
"1506500","12.425","0.0009","21.493","0.001","5.9427","0.0004","90","","90","","90","","1587","0.17","296.2","","296.2","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H17 Br O3 -","- C17 H17 Br O3 -","- C68 H68 Br4 O12 -","4","1","","Itoh, Kennosuke; Hasegawa, Masayuki; Tanaka, Junji; Kanemasa, Shuji","Enantioselective enol lactone synthesis under double catalytic conditions.","Organic letters","2005","7","6","979","981","10.1021/ol047872g","","","0.7107","MoKα","","0.0722","0.0513","","","0.1304","0.1466","","","","","","0.94","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506501","11.852","0.008","15.102","0.01","19.607","0.014","74.327","0.014","86.668","0.012","73.37","0.02","3237","4","213","2","213","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H40 N3 O6 -","- C38 H40 N3 O6 -","- C152 H160 N12 O24 -","4","2","","Oguri, Hiroki; Schreiber, Stuart L.","Skeletal diversity via a folding pathway: synthesis of indole alkaloid-like skeletons.","Organic letters","2005","7","1","47","50","10.1021/ol047945w","","","0.71073","MoKα","","0.1747","0.0577","","","0.109","0.1386","","","","","","0.942","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506502","15.165","0.003","11.97","0.003","22.819","0.005","90","","92.248","0.005","90","","4139","1.6","193","2","193","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C43 H47 N7 O10 S -","- C43 H47 N7 O10 S -","- C172 H188 N28 O40 S4 -","4","1","","Oguri, Hiroki; Schreiber, Stuart L.","Skeletal diversity via a folding pathway: synthesis of indole alkaloid-like skeletons.","Organic letters","2005","7","1","47","50","10.1021/ol047945w","","","0.71073","MoKα","","0.0807","0.0539","","","0.121","0.1318","","","","","","1.01","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506503","8.1817","0.0008","18.7309","0.0018","6.28","0.0006","90","","90","","90","","962.41","0.16","298","2","298","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C21 H20 F6 O -","- C21 H20 F6 O -","- C42 H40 F12 O2 -","2","0.5","","Resendiz, Marino J. E.; Garcia-Garibay, Miguel A","Hammett analysis of photodecarbonylation in crystalline 1,3-diarylacetones.","Organic letters","2005","7","3","371","374","10.1021/ol0480527","","","0.71073","MoKα","","0.0431","0.0361","","","0.1015","0.1065","","","","","","1.044","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506504","10.905","0.0006","9.0569","0.0007","13.2693","0.0007","90","","92.194","0.005","90","","1309.59","0.14","293","2","293","2","","","","","","","Synthetized from commercial glucuronolactone","5","P 1 21 1","P 2yb","4","","(3aR,4aS,5R,8aR,8bR)-2,2-dimethyl-8a(benzyloxyamino)-8-phenyl-7- (phenylsulfanyl)-3a,4a,5,6,8a,8b-hexahydrobenzo[4,5]furo[2,3-d][1,3]dioxol-5-ol","","- C30 H31 N O5 S -","- C30 H31 N O5 S -","- C60 H62 N2 O10 S2 -","2","1","","Fernández, Marta; Alonso, Ricardo","Tandem radical addition and cyclization of epsilon-substituted delta-yne ketimines.","Organic letters","2005","7","1","11","14","10.1021/ol048104s","","","1.54184","CuKα","","0.0709","0.0467","","","0.1193","0.1326","","","","","","1.077","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506505","6.8995","0.0011","16.674","0.003","21.421","0.003","90","","90","","90","","2464.3","0.7","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H28 Cl N3 O6 -","- C21 H28 Cl N3 O6 -","- C84 H112 Cl4 N12 O24 -","4","1","","Liu, Xiaofeng; Li, Hongming; Deng, Li","Highly enantioselective amination of alpha-substituted alpha-cyanoacetates with chiral catalysts accessible from both quinine and quinidine.","Organic letters","2005","7","2","167","169","10.1021/ol048190w","","","0.71073","MoKα","","0.0768","0.0366","","","0.0401","0.0436","","","","","","0.844","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506506","6.738","0.0002","9.491","0.0002","10.247","0.0002","63.862","0.0011","79.987","0.0011","76.57","0.001","570.27","0.02","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H4 F4 S4 -","- C14 H4 F4 S2 -","- C28 H8 F8 S4 -","2","1","","Cho, Don M.; Parkin, Sean R.; Watson, Mark D.","Partial fluorination overcomes herringbone crystal packing in small polycyclic aromatics.","Organic letters","2005","7","6","1067","1068","10.1021/ol050019c","","","0.71073","MoKα","","0.0622","0.0373","","","0.0847","0.094","","","","","","1.075","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506507","9.137","0.0002","9.74","0.0002","13.595","0.0003","89.465","0.0009","73.679","0.0009","79.933","0.001","1142.23","0.04","90","2","90","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H28 F4 S2 -","- C26 H28 F4 S2 -","- C52 H56 F8 S4 -","2","1","","Cho, Don M.; Parkin, Sean R.; Watson, Mark D.","Partial fluorination overcomes herringbone crystal packing in small polycyclic aromatics.","Organic letters","2005","7","6","1067","1068","10.1021/ol050019c","","","0.71073","MoKα","","0.0791","0.0434","","","0.1003","0.1169","","","","","","1.015","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506508","13.229","0.0003","5.055","0.0001","16.776","0.0005","90","","108.127","0.0012","90","","1066.18","0.05","90","2","90","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C14 H8 S2 -","- C14 H8 S2 -","- C56 H32 S8 -","4","1","","Cho, Don M.; Parkin, Sean R.; Watson, Mark D.","Partial fluorination overcomes herringbone crystal packing in small polycyclic aromatics.","Organic letters","2005","7","6","1067","1068","10.1021/ol050019c","","","0.71073","MoKα","","0.0534","0.0376","","","0.1038","0.1127","","","","","","1.07","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506509","10.989","0.0005","6.7478","0.0003","16.2987","0.0007","90","","95.001","0.002","90","","1203.97","0.09","90","0.2","90","0.2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C18 H8 F4 -","- C18 H8 F4 -","- C72 H32 F16 -","4","1","","Cho, Don M.; Parkin, Sean R.; Watson, Mark D.","Partial fluorination overcomes herringbone crystal packing in small polycyclic aromatics.","Organic letters","2005","7","6","1067","1068","10.1021/ol050019c","","","1.54178","CuKα","","0.0404","0.0362","","","0.1014","0.1059","","","","","","1.027","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506510","11.3466","0.0005","10.2778","0.0005","11.6638","0.0007","90","","118.642","0.004","90","","1193.76","0.12","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C13 H18 O3 -","- C13 H18 O3 -","- C52 H72 O12 -","4","1","","Reeder, Matthew D.; Srikanth, G. S. C.; Jones, Spencer B.; Castle, Steven L.","Synthesis of the core structure of acutumine.","Organic letters","2005","7","6","1089","1092","10.1021/ol050020b","","","0.71073","MoKα","","0.0532","0.0419","","","0.1131","0.1204","","","","","","1.077","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506511","8.7438","0.0006","7.6589","0.0003","21.3498","0.0009","90","","90.022","0.003","90","","1429.75","0.13","293","","293.15","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C28 H36 Cl2 Cu N2 O4 -","- C28 H36 Cl2 Cu N2 O4 -","- C56 H72 Cl4 Cu2 N4 O8 -","2","1","","Lyle, Michael P. A.; Draper, Neil D.; Wilson, Peter D.","Enantioselective Friedel-Crafts alkylation reactions catalyzed by a chiral nonracemic C2-symmetric 2,2'-bipyridyl copper(II) complex.","Organic letters","2005","7","5","901","904","10.1021/ol050075d","","","1.5418","CuKα","","0.0521","0.0436","","0.148","0.0553","0.0553","","","","","","1.1741","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506512","5.9008","0.0002","9.6079","0.0003","17.7589","0.0006","90","","90","","90","","1006.83","0.06","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C10 H13 N O S -","- C10 H13 N O S -","- C40 H52 N4 O4 S4 -","4","1","","Fernández, Inmaculada; Valdivia, Victoria; Gori, Beatrice; Alcudia, Felipe; Alvarez, Eleuterio; Khiar, Noureddine","The isopropylsulfinyl group: a useful chiral controller for the asymmetric aziridination of sulfinylimines and the organocatalytic allylation of hydrazones.","Organic letters","2005","7","7","1307","1310","10.1021/ol050080h","","","0.71073","MoKα","","0.0248","0.024","","","0.0648","0.0657","","","","","","1.045","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506513","5.9295","0.0006","12.3312","0.0012","16.883","0.0016","90","","90","","90","","1234.4","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H16 Fe O S -","- C13 H16 Fe O S -","- C52 H64 Fe4 O4 S4 -","4","1","","Fernández, Inmaculada; Valdivia, Victoria; Gori, Beatrice; Alcudia, Felipe; Alvarez, Eleuterio; Khiar, Noureddine","The isopropylsulfinyl group: a useful chiral controller for the asymmetric aziridination of sulfinylimines and the organocatalytic allylation of hydrazones.","Organic letters","2005","7","7","1307","1310","10.1021/ol050080h","","","0.71073","MoKα","","0.055","0.0373","","","0.069","0.0742","","","","","","1.031","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506514","10.7905","0.0012","7.675","0.0008","17.5436","0.0019","90","","90","","90","","1452.9","0.3","273","2","273","2","","","","","","","","2","P b c a","-P 2ac 2ab","61","","1,4-Bis-(2-methyl-phenyl)-benzene","","- C20 H18 -","- C20 H18 -","- C80 H72 -","4","0.5","","Lunazzi, Lodovico; Mazzanti, Andrea; Minzoni, Mirko; Anderson, J. Edgar","Structure, conformation, and dynamic processes of the stereolabile atropisomers of hindered terphenyl hydrocarbons.","Organic letters","2005","7","7","1291","1294","10.1021/ol050091a","","","0.71073","MoKα","","0.0492","0.0369","","","0.0976","0.1038","","","","","","1.073","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506515","8.206","0.004","19.137","0.009","7.029","0.003","90","","108.955","0.007","90","","1044","0.8","273","2","273","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","","1,4-Bis-(2-tert-butyl-phenyl)benzene","","- C26 H30 -","- C26 H30 -","- C52 H60 -","2","0.5","","Lunazzi, Lodovico; Mazzanti, Andrea; Minzoni, Mirko; Anderson, J. Edgar","Structure, conformation, and dynamic processes of the stereolabile atropisomers of hindered terphenyl hydrocarbons.","Organic letters","2005","7","7","1291","1294","10.1021/ol050091a","","","0.71073","MoKα","","0.0601","0.0423","","","0.1089","0.1173","","","","","","1.013","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506516","19.569","0.003","9.6463","0.0008","15.091","0.003","90","","116.71","0.02","90","","2544.7","0.8","293","2","293","2","","","","","","","synthesis as described","3","C 1 2/c 1","-C 2yc","15","","","","- C14 H22 O2 -","- C14 H22 O2 -","- C112 H176 O16 -","8","1","","Heim, Ralf; Wiedemann, Stefan; Williams, Craig M.; Bernhardt, Paul V.","Expedient construction of the vibsanin E core without the use of protecting groups.","Organic letters","2005","7","7","1327","1329","10.1021/ol0501222","","x-ray","0.71073","MoKα","","0.1992","0.05","","","0.099","0.145","","","","","","0.956","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506517","8.3731","0.0002","14.2379","0.0001","15.576","0.0002","115.671","0.001","93.9504","0.0005","99.789","0.001","1627.87","0.05","293","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H16 N2 O7 -","- C16 H16 N2 O7 -","- C64 H64 N8 O28 -","4","2","","Ma, Cheng; Yang, Yewei","Thiazolium-mediated multicomponent reactions: a facile synthesis of 3-aminofuran derivatives.","Organic letters","2005","7","7","1343","1345","10.1021/ol0501368","","","0.7107","MoKα","","","0.056","","","","0.163","","","","","","1.005","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506518","8.3581","0.0007","23.522","0.002","7.8293","0.0007","90","","90","","90","","1539.2","0.2","183","2","183","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C20 H16 N4 -","- C20 H16 N4 -","- C80 H64 N16 -","4","1","","Davis, Riju; Tamaoki, Nobuyuki","Novel photochromic spiroheterocyclic molecules via oxidation of 1,8-diaminonaphthalene.","Organic letters","2005","7","8","1461","1464","10.1021/ol050138s","","","0.71073","MoKα","","0.0383","0.0379","","","0.1007","0.1012","","","","","","0.916","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1506519","11.993","0.004","16.027","0.005","7.917","0.003","90","","97.52","0.006","90","","1508.7","0.9","183","2","183","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H15 N3 O -","- C20 H15 N3 O -","- C80 H60 N12 O4 -","4","1","","Davis, Riju; Tamaoki, Nobuyuki","Novel photochromic spiroheterocyclic molecules via oxidation of 1,8-diaminonaphthalene.","Organic letters","2005","7","8","1461","1464","10.1021/ol050138s","","","0.71073","MoKα","","0.1945","0.0704","","","0.1636","0.2408","","","","","","0.94","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506520","13.904","0.003","4.0318","0.0008","14.426","0.003","90","","112.209","0.003","90","","748.7","0.3","183","2","183","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C20 H16 N4 -","- C20 H16 N4 -","- C40 H32 N8 -","2","0.5","","Davis, Riju; Tamaoki, Nobuyuki","Novel photochromic spiroheterocyclic molecules via oxidation of 1,8-diaminonaphthalene.","Organic letters","2005","7","8","1461","1464","10.1021/ol050138s","","","0.71069","MoKα","","0.0595","0.0487","","","0.1378","0.1485","","","","","","1.038","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1506521","22.607","0.003","5.3689","0.0008","24.359","0.004","90","","90","","90","","2956.6","0.8","183","2","183","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C20 H15 N3 O -","- C20 H15 N3 O -","- C160 H120 N24 O8 -","8","1","","Davis, Riju; Tamaoki, Nobuyuki","Novel photochromic spiroheterocyclic molecules via oxidation of 1,8-diaminonaphthalene.","Organic letters","2005","7","8","1461","1464","10.1021/ol050138s","","","0.71073","MoKα","","0.1487","0.0553","","","0.1061","0.1358","","","","","","0.966","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1506522","4.9575","0.0006","15.1933","0.0018","18.374","0.002","90","","90","","90","","1383.9","0.3","203","2","203","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H13 N3 -","- C20 H13 N3 -","- C80 H52 N12 -","4","1","","Davis, Riju; Tamaoki, Nobuyuki","Novel photochromic spiroheterocyclic molecules via oxidation of 1,8-diaminonaphthalene.","Organic letters","2005","7","8","1461","1464","10.1021/ol050138s","","","0.71073","MoKα","","0.0595","0.0505","","","0.1272","0.1348","","","","","","0.982","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506523","7.4462","0.0008","7.8786","0.0009","13.6251","0.0015","90","","91.258","0.002","90","","799.13","0.15","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C10 H8 N2 O -","- C10 H8 N2 O -","- C40 H32 N8 O4 -","4","1","","Davis, Riju; Tamaoki, Nobuyuki","Novel photochromic spiroheterocyclic molecules via oxidation of 1,8-diaminonaphthalene.","Organic letters","2005","7","8","1461","1464","10.1021/ol050138s","","","0.71069","MoKα","","0.0519","0.0459","","","0.13","0.1363","","","","","","1.086","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1506524","15.686","0.003","12.04","0.002","7.8796","0.0015","90","","90","","90","","1488.1","0.5","203","2","203","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C20 H15 N3 O -","- C20 H15 N3 O -","- C80 H60 N12 O4 -","4","1","","Davis, Riju; Tamaoki, Nobuyuki","Novel photochromic spiroheterocyclic molecules via oxidation of 1,8-diaminonaphthalene.","Organic letters","2005","7","8","1461","1464","10.1021/ol050138s","","","0.71073","MoKα","","0.0633","0.0355","","","0.0855","0.1145","","","","","","1.086","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1506525","7.8283","0.00001","10.626","0.0002","11.105","0.0002","89.465","0.001","75.808","0.001","72.908","0.001","854.04","0.02","153","2","153","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H52 N4 O4 -","- C38 H52 N4 O4 -","- C38 H52 N4 O4 -","1","0.5","","Sessler, Jonathan L.; Aguilar, Apolonio; Sanchez-Garcia, David; Seidel, Daniel; Köhler, Thomas; Arp, Forrest; Lynch, Vincent M.","Facile syntheses of quater-, penta-, and sexipyrroles.","Organic letters","2005","7","10","1887","1890","10.1021/ol050151c","","","0.71073","MoKα","","0.0623","0.041","","","0.0917","0.1023","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506526","8.5826","0.0001","10.7345","0.0001","34.6417","0.0005","88.214","0.001","83.085","0.001","74.848","0.001","3058.18","0.07","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H56 F18 N6 O16 -","- C54 H55 F18 N6 O16 -","- C108 H110 F36 N12 O32 -","2","1","","Sessler, Jonathan L.; Aguilar, Apolonio; Sanchez-Garcia, David; Seidel, Daniel; Köhler, Thomas; Arp, Forrest; Lynch, Vincent M.","Facile syntheses of quater-, penta-, and sexipyrroles.","Organic letters","2005","7","10","1887","1890","10.1021/ol050151c","","","0.71073","MoKα","","0.1253","0.0735","","","0.1357","0.1572","","","","","","1.156","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506527","10.4318","0.0005","14.7988","0.0006","35.7592","0.0015","90","","90","","90","","5520.4","0.4","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H32 N2 O5 -","- C30 H32 N2 O5 -","- C240 H256 N16 O40 -","8","2","","Wipf, Peter; Stephenson, Corey R. J.","Three-component synthesis of alpha,beta-cyclopropyl-gamma-amino acids.","Organic letters","2005","7","6","1137","1140","10.1021/ol0501525","","","0.71073","MoKα","","0.135","0.0673","","","0.1393","0.1639","","","","","","0.95","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506528","5.3668","0.0003","14.348","0.0007","23.0874","0.0011","90","","90","","90","","1777.8","0.16","571","2","571","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C19 H18 Br N O3 -","- C19 H18 Br N O3 -","- C76 H72 Br4 N4 O12 -","4","1","","Wipf, Peter; Stephenson, Corey R. J.","Three-component synthesis of alpha,beta-cyclopropyl-gamma-amino acids.","Organic letters","2005","7","6","1137","1140","10.1021/ol0501525","","","0.71073","MoKα","","0.1031","0.0432","","","0.0849","0.1043","","","","","","0.955","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506529","6.8454","0.0002","7.4615","0.0003","27.2798","0.0012","90","","91.069","0.002","90","","1393.13","0.09","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[2-(4-methoxybenzyl)phenyl]morpholine","","- C18 H21 N O2 -","- C18 H21 N O2 -","- C72 H84 N4 O8 -","4","1","","Rosamilia, Anthony E.; Scott, Janet L.; Strauss, Christopher R.","Preparation of 2- and 4-arylmethyl N-substituted and N,N-disubstituted anilines via a ""green"", multicomponent reaction.","Organic letters","2005","7","8","1525","1528","10.1021/ol0501828","","","0.71073","MoKα","","0.1373","0.0503","","","0.0978","0.1238","","","","","","0.941","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506530","9.2593","0.0002","16.1551","0.0003","10.1261","0.0002","90","","101.834","0.001","90","","1482.52","0.05","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","4-[4-(4-methoxybenzyl)phenyl]morpholine","","- C18 H21 N O2 -","- C18 H21 N O2 -","- C72 H84 N4 O8 -","4","1","","Rosamilia, Anthony E.; Scott, Janet L.; Strauss, Christopher R.","Preparation of 2- and 4-arylmethyl N-substituted and N,N-disubstituted anilines via a ""green"", multicomponent reaction.","Organic letters","2005","7","8","1525","1528","10.1021/ol0501828","","","0.71073","MoKα","","0.1084","0.0477","","","0.0969","0.1182","","","","","","1.014","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506531","11.8742","0.0004","14.427","0.0003","11.6716","0.0005","90","","90","","90","","1999.45","0.12","123","2","123","2","","","","","","","","3","P n a 21","P 2c -2n","33","","N-benzyl-(2-benzyl,4-tolyl)aniline","","- C27 H25 N -","- C27 H25 N -","- C108 H100 N4 -","4","1","","Rosamilia, Anthony E.; Scott, Janet L.; Strauss, Christopher R.","Preparation of 2- and 4-arylmethyl N-substituted and N,N-disubstituted anilines via a ""green"", multicomponent reaction.","Organic letters","2005","7","8","1525","1528","10.1021/ol0501828","","","0.71073","MoKα","","0.0828","0.0432","","","0.0822","0.0958","","","","","","1.057","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506532","5.1091","0.0016","8.604","0.003","11.779","0.004","96.15","0.006","99.491","0.006","103.281","0.005","491.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","3mepyox-ICCCCI","1-3 Co-crystal","","- C18 H14 I2 N4 O2 -","- C18 H14 I2 N4 O2 -","- C18 H14 I2 N4 O2 -","1","0.5","","Goroff, Nancy S.; Curtis, Sean M.; Webb, Jeffrey A.; Fowler, Frank W.; Lauher, Joseph W.","Designed cocrystals based on the pyridine-iodoalkyne halogen bond.","Organic letters","2005","7","10","1891","1893","10.1021/ol050184s","","","0.71073","MoKα","","0.0969","0.0589","","","0.1388","0.1518","","","","","","0.849","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506533","5.0225","0.0014","13.367","0.004","16.614","0.005","111.708","0.004","96.629","0.005","90.382","0.004","1027.9","0.5","293","2","293","2","","","","","","","","5","P -1","-P 1","2","4mepyox-ICCCCI","1-4 Co-crystal","","- C18 H14 I2 N4 O2 -","- C18 H14 I2 N4 O2 -","- C36 H28 I4 N8 O4 -","2","1","","Goroff, Nancy S.; Curtis, Sean M.; Webb, Jeffrey A.; Fowler, Frank W.; Lauher, Joseph W.","Designed cocrystals based on the pyridine-iodoalkyne halogen bond.","Organic letters","2005","7","10","1891","1893","10.1021/ol050184s","","","0.71073","MoKα","","0.137","0.0633","","","0.144","0.1719","","","","","","0.885","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506534","4.5341","0.0005","33.343","0.004","14.4556","0.0017","90","","93.812","0.002","90","","2180.6","0.4","293","2","293","2","","","","","","","","5","P 1 n 1","P -2yac","7","3mepy-ur-ICCCCI","1-5 Co-crystal","","- C18 H14 I2 N4 O2 -","- C18 H14 I2 N4 O2 -","- C72 H56 I8 N16 O8 -","4","2","","Goroff, Nancy S.; Curtis, Sean M.; Webb, Jeffrey A.; Fowler, Frank W.; Lauher, Joseph W.","Designed cocrystals based on the pyridine-iodoalkyne halogen bond.","Organic letters","2005","7","10","1891","1893","10.1021/ol050184s","","","0.71073","MoKα","","0.1251","0.0686","","","0.2128","0.1944","","","","","","0.961","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506535","4.517","0.005","26.92","0.03","8.586","0.01","90","","93.546","0.018","90","","1042","2","293","2","293","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","4mepyur-ICCCCI","1-6 co-crystal","","- C18 H14 I2 N4 O2 -","- C18 H14 I2 N4 O2 -","- C36 H28 I4 N8 O4 -","2","0.5","","Goroff, Nancy S.; Curtis, Sean M.; Webb, Jeffrey A.; Fowler, Frank W.; Lauher, Joseph W.","Designed cocrystals based on the pyridine-iodoalkyne halogen bond.","Organic letters","2005","7","10","1891","1893","10.1021/ol050184s","","","0.71073","MoKα","","0.1819","0.059","","","0.0984","0.1894","","","","","","0.928","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506536","5.2844","0.0011","8.4501","0.0018","12.202","0.003","77.709","0.004","78.835","0.004","83.769","0.004","521","0.2","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-3 Co-crystal","","- C20 H14 I2 N4 O2 -","- C20 H14 I2 N4 O2 -","- C20 H14 I2 N4 O2 -","1","0.5","","Goroff, Nancy S.; Curtis, Sean M.; Webb, Jeffrey A.; Fowler, Frank W.; Lauher, Joseph W.","Designed cocrystals based on the pyridine-iodoalkyne halogen bond.","Organic letters","2005","7","10","1891","1893","10.1021/ol050184s","","","0.71073","MoKα","","0.0836","0.0573","","","0.135","0.1472","","","","","","0.923","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506537","4.9734","0.0015","9.899","0.003","11.033","0.003","96.605","0.005","95.183","0.005","99.824","0.006","528.3","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","2-4 Co-Crystal","","- C20 H14 I2 N4 O2 -","- C20 H14 I2 N4 O2 -","- C20 H14 I2 N4 O2 -","1","0.5","","Goroff, Nancy S.; Curtis, Sean M.; Webb, Jeffrey A.; Fowler, Frank W.; Lauher, Joseph W.","Designed cocrystals based on the pyridine-iodoalkyne halogen bond.","Organic letters","2005","7","10","1891","1893","10.1021/ol050184s","","","0.71073","MoKα","","0.1049","0.0669","","","0.1626","0.1828","","","","","","0.902","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506538","8.304","0.0002","8.875","0.0003","20.562","0.0007","90","","91.997","0.0011","90","","1514.46","0.08","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","compound 14","(3S)-Tetahydro-3-[(1R,2R,4R,5S)-2-hydroxyl-spiro[3-oxa-7-thiabicyclo[3.3.1]nonane-9,2'-[1,3]dioxolane]-4-yl]-4H-thiopyran-4-one","","- C14 H20 O5 S2 -","- C14 H20 O5 S2 -","- C56 H80 O20 S8 -","4","1","","Ward, Dale E.; Jheengut, Vishal; Akinnusi, Olukayode T.","Enantioselective direct intermolecular aldol reactions with enantiotopic group selectivity and dynamic kinetic resolution.","Organic letters","2005","7","6","1181","1184","10.1021/ol050195l","","","0.71073","MoKα","","0.0773","0.0496","","","0.1237","0.1374","","","","","","1.033","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506539","20.556","0.0008","5.32","0.0003","15.025","0.0007","90","","95.915","0.002","90","","1634.35","0.14","173","2","173","2","","","","","","","","4","C 1 2 1","C 2y","5","compound 15","(3R,4S)-3-{(R)-Hydroxy-[(6S,10R)-10-hydroxymethyl- 1,4-dioxa-8-thiaspiro[4.5]dec-6-yl]methyl}- tetrahydro-2H-thiopyran-4-ol","","- C14 H26 O6 S2 -","- C14 H26 O6 S2 -","- C56 H104 O24 S8 -","4","1","","Ward, Dale E.; Jheengut, Vishal; Akinnusi, Olukayode T.","Enantioselective direct intermolecular aldol reactions with enantiotopic group selectivity and dynamic kinetic resolution.","Organic letters","2005","7","6","1181","1184","10.1021/ol050195l","","","0.71073","MoKα","","0.0552","0.0436","","","0.0854","0.091","","","","","","1.094","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506540","8.0389","0.0011","14.888","0.002","14.573","0.002","90","","100.433","0.003","90","","1715.3","0.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H16 O6 -","- C20 H16 O6 -","- C80 H64 O24 -","4","1","","Nair, Vijay; Pillai, Abhilash N.; Menon, Rajeev S.; Suresh, Eringathodi","Pyridine-catalyzed addition of diaryl-1,2-diones to dimethyl butynedioate leading to the formation of 1,2-diaroyl dimethyl maleates via an unprecedented rearrangement.","Organic letters","2005","7","6","1189","1191","10.1021/ol050225k","","","0.71073","MoKα","","0.0915","0.0652","","","0.1674","0.1886","","","","","","1.047","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506541","6.854","0.003","14.08","0.004","20.093","0.009","90","","90","","90","","1939.1","1.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H32 O3 -","- C20 H32 O3 -","- C80 H128 O12 -","4","1","","Jeffery, David W.; Perkins, Michael V.; White, Jonathan M.","Synthesis of the putative structure of tridachiahydropyrone.","Organic letters","2005","7","8","1581","1584","10.1021/ol050236d","","","1.5418","CuKα","","0.3284","0.1065","","","0.1767","0.2657","","","","","","0.974","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506542","9.079","0.002","10.386","0.003","11.448","0.003","64.851","0.005","77.443","0.005","72.753","0.005","928","0.4","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C20 H26 O3 S -","- C20 H26 O3 S -","- C40 H52 O6 S2 -","2","1","","Souto, José A; López, Carlos Silva; Faza, Olalla Nieto; Alvarez, Rosana; de Lera, Angel R.","2-Alkylidenesulfol-3-enes by (regio- and) stereoselective cheletropic addition of SO2 to (di)vinylallenes.","Organic letters","2005","7","8","1565","1568","10.1021/ol050240p","","","0.71073","MoKα","","0.114","0.0772","","","0.246","0.2612","","","","","","1.104","","","","has coordinates","194547","2020-10-21","18:00:00",""
"1506543","9.7494","0.0008","12.3191","0.0011","12.4391","0.0011","101.789","0.001","111.839","0.001","107.544","0.001","1234.86","0.19","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","P,P-diphenyl-N-(1-dimethylphenylsilyl-3-methylmethylene)-phosphinic amide","","- C28 H30 N O P Si -","- C28 H30 N O P Si -","- C56 H60 N2 O2 P2 Si2 -","2","1","","Ballweg, David M.; Miller, Rebecca C.; Gray, Danielle L.; Scheidt, Karl A.","Stereoselective synthesis of alpha-silylamines by the direct addition of silyl anions to activated imines.","Organic letters","2005","7","7","1403","1406","10.1021/ol050244u","","","0.71073","MoKα","","0.0744","0.0492","","","0.118","0.1308","","","","","","1.001","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506544","6.4269","0.0008","16.553","0.002","18.276","0.002","90","","90","","90","","1944.3","0.4","153","2","153","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(S(S),S) N-(1-dimethylphenylsilylphenylmethylene)-t-butanesulfinamide","","- C19 H27 N O S Si -","- C19 H27 N O S Si -","- C76 H108 N4 O4 S4 Si4 -","4","1","","Ballweg, David M.; Miller, Rebecca C.; Gray, Danielle L.; Scheidt, Karl A.","Stereoselective synthesis of alpha-silylamines by the direct addition of silyl anions to activated imines.","Organic letters","2005","7","7","1403","1406","10.1021/ol050244u","","","0.71073","MoKα","","0.1208","0.062","","","0.1144","0.1353","","","","","","0.966","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506545","6.5692","0.0013","15.207","0.003","20.303","0.004","90","","90","","90","","2028.2","0.7","153","2","153","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(R(S),R)-1-dimethylphenyl-2,2-dimethylpropyl)-t-butanesulfinamide","","- C17 H33 N O2 S Si -","- C17 H33 N O2 S Si -","- C68 H132 N4 O8 S4 Si4 -","4","1","","Ballweg, David M.; Miller, Rebecca C.; Gray, Danielle L.; Scheidt, Karl A.","Stereoselective synthesis of alpha-silylamines by the direct addition of silyl anions to activated imines.","Organic letters","2005","7","7","1403","1406","10.1021/ol050244u","","","0.71073","MoKα","","0.147","0.0592","","","0.1058","0.1279","","","","","","0.877","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506546","10.446","0.005","15.755","0.005","19.741","0.005","101.976","0.005","91.797","0.005","98.325","0.005","3138","2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C66 H71 N9 O13 -","- C66 H71 N9 O13 -","- C132 H142 N18 O26 -","2","1","","Bag, Bamaprasad; Bharadwaj, Parimal K.","Attachment of electron-withdrawing 2,4-dinitrobenzene groups to a cryptand-based receptor for Cu(II)/H+ specific exciplex and monomer emissions.","Organic letters","2005","7","8","1573","1576","10.1021/ol050254v","","","0.71069","MoKα","","0.087","0.0674","","","0.187","0.2032","","","","","","1.034","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506547","12.495","0.0003","33.601","0.0001","14.107","0.0002","90","","110.001","0.003","90","","5565.53","0.19","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C69 H67 N7 O7 -","- C69 H67 N7 O7 -","- C276 H268 N28 O28 -","4","1","","Bag, Bamaprasad; Bharadwaj, Parimal K.","Attachment of electron-withdrawing 2,4-dinitrobenzene groups to a cryptand-based receptor for Cu(II)/H+ specific exciplex and monomer emissions.","Organic letters","2005","7","8","1573","1576","10.1021/ol050254v","","","0.71073","MoKα","","0.0808","0.061","","","0.1705","0.1836","","","","","","1.024","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506548","13.143","0.005","13.52","0.005","18.853","0.005","85.665","0.005","71.885","0.005","76.671","0.005","3098.2","1.8","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C64 H66 Cl N11 O15 -","- C64 H66 Cl N11 O15 -","- C128 H132 Cl2 N22 O30 -","2","1","","Bag, Bamaprasad; Bharadwaj, Parimal K.","Attachment of electron-withdrawing 2,4-dinitrobenzene groups to a cryptand-based receptor for Cu(II)/H+ specific exciplex and monomer emissions.","Organic letters","2005","7","8","1573","1576","10.1021/ol050254v","","","0.71073","MoKα","","0.1073","0.0729","","","0.1865","0.2147","","","","","","0.977","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506549","20.937","0.005","13.542","0.005","24.926","0.005","90","0.005","92.507","0.005","90","0.005","7060","3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C75 H80 Cl2 N10 O16 -","- C75 H78 Cl2 N10 O16 -","- C300 H312 Cl8 N40 O64 -","4","1","","Bag, Bamaprasad; Bharadwaj, Parimal K.","Attachment of electron-withdrawing 2,4-dinitrobenzene groups to a cryptand-based receptor for Cu(II)/H+ specific exciplex and monomer emissions.","Organic letters","2005","7","8","1573","1576","10.1021/ol050254v","","","0.71069","MoKα","","0.1125","0.0798","","","0.165","0.1806","","","","","","1.098","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506550","9.9387","0.0013","11.7542","0.0016","15.485","0.002","90","","90","","90","","1809","0.4","100","2","100","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C9 H14 O4 -","- C9 H14 O4 -","- C72 H112 O32 -","8","1","","Aspinall, Helen C.; Greeves, Nicholas; Valla, Carine","Samarium diiodide-catalyzed diastereoselective pinacol couplings.","Organic letters","2005","7","10","1919","1922","10.1021/ol050256f","","","0.71073","MoKα","","0.0493","0.0381","","","0.0931","0.0971","","","","","","0.958","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506551","15.9393","0.0014","29.73","0.003","12.2145","0.0011","90","","92.481","0.002","90","","5782.7","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C29 H36 F3 N2 O3.5 -","- C29 H36 F3 N2 O3.5 -","- C232 H288 F24 N16 O28 -","8","1","","Nair, Vijay; Sreekumar, V.; Bindu, S.; Suresh, Eringathodi","Two unprecedented multicomponent reactions involving N-heterocyclic carbenes, activated acetylenes, and aldehydes.","Organic letters","2005","7","12","2297","2300","10.1021/ol0502782","","","0.71073","MoKα","","0.0867","0.0707","","","0.1923","0.2074","","","","","","1.038","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506552","9.2322","0.0015","17.385","0.003","9.8198","0.0016","90","","101.64","0.003","90","","1543.7","0.4","273","2","273","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C30 H38 F N2 O9 -","- C30 H38 F N2 O9 -","- C60 H76 F2 N4 O18 -","2","1","","Nair, Vijay; Sreekumar, V.; Bindu, S.; Suresh, Eringathodi","Two unprecedented multicomponent reactions involving N-heterocyclic carbenes, activated acetylenes, and aldehydes.","Organic letters","2005","7","12","2297","2300","10.1021/ol0502782","","","0.71073","MoKα","","0.0528","0.0472","","","0.131","0.1439","","","","","","1.073","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506553","11.791","0.002","17.038","0.003","17.969","0.004","90","","74.07","0.03","90","","3471.3","1.3","293","2","293","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C78 H81 B N2 O2 P2 Ru -","- C78 H81 B N2 O2 P2 Ru -","- C156 H162 B2 N4 O4 P4 Ru2 -","2","1","","Guo, Rongwei; Chen, Xuanhua; Elpelt, Christian; Song, Datong; Morris, Robert H.","Applications of ruthenium hydride borohydride complexes containing phosphinite and diamine ligands to asymmetric catalytic reactions.","Organic letters","2005","7","9","1757","1759","10.1021/ol050336j","","","0.71073","MoKα","","0.2171","0.0703","","","0.1273","0.1752","","","","","","0.94","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506554","18.059","0.004","18.096","0.004","21.949","0.004","90","","90","","90","","7173","3","150","2","150","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C81.6 H89.4 B N2 O2 P2 Ru -","- C81.6 H81 B N2 O2 P2 Ru -","- C326.4 H324 B4 N8 O8 P8 Ru4 -","4","1","","Guo, Rongwei; Chen, Xuanhua; Elpelt, Christian; Song, Datong; Morris, Robert H.","Applications of ruthenium hydride borohydride complexes containing phosphinite and diamine ligands to asymmetric catalytic reactions.","Organic letters","2005","7","9","1757","1759","10.1021/ol050336j","","","0.71073","MoKα","","0.2101","0.0624","","","0.09","0.1216","","","","","","0.927","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506555","27.093","0.004","6.392","0.0013","10.547","0.0007","90","","90","","90","","1826.5","0.5","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","3-Bromo-5-(4-chlorohenyl)-2-(4-tertbutylphenyl)furan","","- C20 H18 Br Cl O -","- C20 H18 Br Cl O -","- C80 H72 Br4 Cl4 O4 -","4","1","","Sniady, Adam; Wheeler, Kraig A.; Dembinski, Roman","5-Endo-dig electrophilic cyclization of 1,4-disubstituted but-3-yn-1-ones: regiocontrolled synthesis of 2,5-disubstituted 3-bromo- and 3-iodofurans.","Organic letters","2005","7","9","1769","1772","10.1021/ol050372i","","","0.71073","MoKα","","0.1168","0.0502","","","0.0877","0.1065","","","","","","1.019","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506556","7.8832","0.0012","17.578","0.003","9.3048","0.0014","90","","93.894","0.002","90","","1286.4","0.4","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H11 Cl O3 -","- C15 H11 Cl O3 -","- C60 H44 Cl4 O12 -","4","1","","Calter, Michael A.; Tretyak, Olexandr A.; Flaschenriem, Christine","Formation of disubstituted beta-lactones using bifunctional catalysis.","Organic letters","2005","7","9","1809","1812","10.1021/ol050411q","","","0.71073","MoKα","","0.1605","0.1329","","","0.2569","0.2689","","","","","","1.38","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506557","6.9632","0.0014","9.5308","0.0017","15.805","0.003","90","","91.416","0.004","90","","1048.6","0.3","103","2","103","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H33 N O5 -","- C24 H33 N O5 -","- C48 H66 N2 O10 -","2","1","","Wu, Huifang; Thatcher, Linn N.; Bernard, Denzil; Parrish, Damon A.; Deschamps, Jeffrey R.; Rice, Kenner C.; MacKerell, Jr, Alexander D; Coop, Andrew","Position of coordination of the lithium ion determines the regioselectivity of demethylations of 3,4-dimethoxymorphinans with L-selectride.","Organic letters","2005","7","13","2531","2534","10.1021/ol050433c","","","0.71073","MoKα","","0.0599","0.0471","","","0.1171","0.1373","","","","","","1.052","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506558","14.251","0.001","6.4802","0.0005","19.219","0.001","90","","97.679","0.003","90","","1758.9","0.2","213","2","213","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C39 H52 O3 -","- C39 H52 O3 -","- C78 H104 O6 -","2","1","","Kumar, Nilesh; Kiuchi, Masatoshi; Tallarico, John A.; Schreiber, Stuart L.","Small-molecule diversity using a skeletal transformation strategy.","Organic letters","2005","7","13","2535","2538","10.1021/ol0504345","","","0.71073","MoKα","","0.1032","0.0697","","","0.1737","0.1952","","","","","","1.023","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506559","18.578","0.003","13.143","0.002","21.494","0.003","90","","111.874","0.003","90","","4870.4","1.3","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H72 N4 O4 -","- C52 H72 N4 O4 -","- C208 H288 N16 O16 -","4","1","","Simaan, Samah; Biali, Silvio E.","Preferential axial protonation in a zwitterionic calix[4]arene.","Organic letters","2005","7","9","1817","1820","10.1021/ol0504392","","","0.71073","MoKα","","0.071","0.0554","","","0.1413","0.1494","","","","","","1.049","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506560","8.136","0.001","8.542","0.002","10.627","0.003","84.959","0.006","73.671","0.007","69.347","0.005","663.2","0.3","293","1","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H13 N O6 -","- C13 H13 N O6 -","- C26 H26 N2 O12 -","2","1","","Ding, Hanfeng; Ma, Cheng; Yang, Yewei; Wang, Yanguang","Unexpected reaction of dimethyl acetylenedicarboxylate with in situ generated arylketenes catalyzed by 1-methylimidazole.","Organic letters","2005","7","11","2125","2127","10.1021/ol050492q","","","0.7107","MoKα","","","0.054","","","","0.163","","","","","","1.003","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506561","23.64","0.01","16.89","0.006","12.682","0.005","90","","116.4","0.03","90","","4536","3","173.1","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- C48 H68 N4 O4 -","- C48.04 H38 N4 O4 -","- C192.16 H152 N16 O16 -","4","0.5","","Tsue, Hirohito; Ishibashi, Koichi; Takahashi, Hiroki; Tamura, Rui","Exhaustively methylated azacalix[4]arene: preparation, conformation, and crystal structure with exclusively CH/pi-controlled crystal architecture.","Organic letters","2005","7","11","2165","2168","10.1021/ol050493i","","","0.7107","MoKα","","","0.092","","","","0.136","","","","","","1.142","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506562","10.059","0.0011","5.9759","0.0007","13.3917","0.0015","90","","108.39","0.002","90","","763.89","0.15","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H18 N2 O5 -","- C17 H18 N2 O5 -","- C34 H36 N4 O10 -","2","1","","Alvarez de Cienfuegos, Luis; Mota, Antonio J.; Robles, Rafael","Convenient synthesis of nucleoside and isonucleoside analogues.","Organic letters","2005","7","11","2161","2164","10.1021/ol050496v","","","0.71073","MoKα","","0.0523","0.0479","","","0.1169","0.1199","","","","","","1.031","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506563","7.872","0.001","7.923","0.001","9.822","0.001","90","","98.156","0.009","90","","606.4","0.13","296.2","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C13 H18 O3 -","- C13 H18 O3 -","- C26 H36 O6 -","2","1","","Yasuda, Makoto; Tanaka, Shin-Ya; Baba, Akio","Reductive cross-aldol reaction using bromoaldehyde and an aldehyde mediated by germanium(II): one-pot, large-scale protocol.","Organic letters","2005","7","9","1845","1848","10.1021/ol050533i","","","0.7107","MoKα","","","0.0521","","","","0.1256","","","","","","2.159","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506564","8.6325","0.0011","8.2795","0.001","9.4032","0.0012","90","","108.713","0.002","90","","636.55","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C6 H9 N O2 -","- C6 H9 N O2 -","- C24 H36 N4 O8 -","4","1","","Hu, Tianshun; Li, Chaozhong","Synthesis of lactams via copper-catalyzed intramolecular vinylation of amides.","Organic letters","2005","7","10","2035","2038","10.1021/ol0505555","","","0.71073","MoKα","","0.0844","0.0738","","","0.2128","0.2232","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506565","7.6969","0.0012","9.6905","0.0014","16.428","0.002","90","","90","","90","","1225.3","0.3","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H18 N2 O2 -","- C12 H18 N2 O2 -","- C48 H72 N8 O8 -","4","0.5","","Hu, Tianshun; Li, Chaozhong","Synthesis of lactams via copper-catalyzed intramolecular vinylation of amides.","Organic letters","2005","7","10","2035","2038","10.1021/ol0505555","","","0.71073","MoKα","","0.0645","0.0474","","","0.1166","0.127","","","","","","0.97","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506566","10.1516","0.0005","15.4731","0.0008","26.0575","0.0013","90","","100.362","0.002","90","","4026.3","0.4","90","2","90","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Nonachloroazatriquinacene - C60","","","- C69 Cl9 N -","- C69 Cl9 N -","- C276 Cl36 N4 -","4","1","","Pham, David; Cerón Bertran, Jordi; Olmstead, Marilyn M.; Mascal, Mark; Balch, Alan L.","Interaction of fullerenes with the concave surfaces of perchloroazatriquinacene.","Organic letters","2005","7","14","2805","2808","10.1021/ol050557p","","","0.71073","MoKα","","0.0547","0.0383","","","0.0998","0.1109","","","","","","1.011","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506567","16.844","0.003","19.929","0.004","26.869","0.005","90","","90","","90","","9019","3","90","2","90","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","Nanochloroazatriquinacene - C70","","","- C79 Cl9 N -","- C79 Cl9 N -","- C632 Cl72 N8 -","8","1","","Pham, David; Cerón Bertran, Jordi; Olmstead, Marilyn M.; Mascal, Mark; Balch, Alan L.","Interaction of fullerenes with the concave surfaces of perchloroazatriquinacene.","Organic letters","2005","7","14","2805","2808","10.1021/ol050557p","","","0.71073","MoKα","","0.0508","0.0391","","","0.1048","0.1132","","","","","","1.008","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506568","9.6285","0.0009","10.2351","0.0009","15.0732","0.0013","90","","90","","90","","1485.4","0.2","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H11 F2 N O2 -","- C6 H11 F2 N O2 -","- C48 H88 F16 N8 O16 -","8","2","","Wang, Ruo-Wen; Qing, Feng-Ling","Highly stereocontrolled synthesis of gem-difluoromethylenated azasugars: D- and L-1,4,6-trideoxy-4,4-difluoronojirimycin.","Organic letters","2005","7","11","2189","2192","10.1021/ol050558h","","","0.71073","MoKα","","0.0435","0.0413","","","0.0978","0.0994","","","","","","1.035","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506569","6.8517","0.0011","39.307","0.007","7.0654","0.0011","90","","115.035","0.003","90","","1724.1","0.5","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H23 N O5 -","- C18 H23 N O5 -","- C72 H92 N4 O20 -","4","2","","Morin, Matthew D.; Rychnovsky, Scott D.","Reductive spiroannulation of nitriles with secondary electrophiles.","Organic letters","2005","7","10","2051","2053","10.1021/ol050567q","","","0.71073","MoKα","","0.0752","0.0629","","","0.1711","0.1936","","","","","","1.11","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506570","9.6051","0.0009","7.4837","0.0007","11.8595","0.0011","90","","99.663","0.002","90","","840.39","0.14","163","2","163","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H23 N O5 -","- C18 H23 N O5 -","- C36 H46 N2 O10 -","2","1","","Morin, Matthew D.; Rychnovsky, Scott D.","Reductive spiroannulation of nitriles with secondary electrophiles.","Organic letters","2005","7","10","2051","2053","10.1021/ol050567q","","","0.71073","MoKα","","0.0516","0.0376","","","0.089","0.0967","","","","","","1.022","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506571","11.262","0.002","6.1691","0.0012","21.598","0.004","90","","96.62","0.03","90","","1490.5","0.5","173","2","173","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 O3 -","- C16 H26 O3 -","- C64 H104 O12 -","4","1","","Aggarwal, Varinder K.; Patin, Amaury; Tisserand, Steve","Highly diastereoselective Diels-Alder reactions of Baylis-Hillman adducts.","Organic letters","2005","7","13","2555","2557","10.1021/ol050584f","","","0.71073","MoKα","","0.0567","0.053","","","0.1223","0.1246","","","","","","1.148","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506572","10.687","0.002","7.678","0.0015","28.81","0.006","90","","96.29","0.03","90","","2349.8","0.8","293","2","293","2","","","","","","","","4","I 1 2/a 1","-I 2ya","15","","","","- C12 H19 N O4 -","- C12 H19 N O4 -","- C96 H152 N8 O32 -","8","1","","Giorgi, Giorgio; Miranda, Sonia; López-Alvarado, Pilar; Avendaño, Carmen; Rodriguez, Jean; Menéndez, J Carlos","Unique Michael addition-initiated domino reaction for the stereoselective synthesis of functionalized macrolactones from alpha-nitroketones in water.","Organic letters","2005","7","11","2197","2200","10.1021/ol0505860","","","1.5418","CuKα","","0.2185","0.0919","","0.2781","0.1988","","","","1.076","1.529","1.529","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506573","13.274","0.003","12.007","0.002","12.039","0.002","90","","94.65","0.03","90","","1912.5","0.6","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H25 Br N2 O3 -","- C18 H25 Br N2 O3 -","- C72 H100 Br4 N8 O12 -","4","2","","Sibi, Mukund P.; Ma, Zhihua; Itoh, Kennosuke; Prabagaran, Narayanasamy; Jasperse, Craig P.","Enantioselective cycloadditions with alpha,beta-disubstituted acrylimides.","Organic letters","2005","7","12","2349","2352","10.1021/ol050599d","","","0.71073","MoKα","","0.1606","0.0424","","","0.0816","0.1231","","","","","","1.068","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506574","9.6042","0.0019","11.448","0.002","17.97","0.004","90","","91.28","0.03","90","","1975.3","0.7","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C19 H25 Br N2 O3 -","- C19 H25.5 Br N2 O3 -","- C76 H102 Br4 N8 O12 -","4","2","","Sibi, Mukund P.; Ma, Zhihua; Itoh, Kennosuke; Prabagaran, Narayanasamy; Jasperse, Craig P.","Enantioselective cycloadditions with alpha,beta-disubstituted acrylimides.","Organic letters","2005","7","12","2349","2352","10.1021/ol050599d","","","0.71073","MoKα","","0.174","0.0456","","","0.0835","0.1165","","","","","","0.979","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506575","12.335","0.003","19.218","0.003","8.483","0.002","90","","90","","90","","2010.9","0.8","183","1","183","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C14 H18 Cl2 F5 O2 P2 Rh -","- C14 H18 Cl2 F5 O2 P2 Rh -","- C56 H72 Cl8 F20 O8 P8 Rh4 -","4","1","","Kashiwabara, Taigo; Kataoka, Kyoko; Hua, Ruimao; Shimada, Shigeru; Tanaka, Masato","CO-retentive addition reactions of fluorinated acid chlorides to alkynes.","Organic letters","2005","7","11","2241","2244","10.1021/ol050632w","","","0.7107","MoKα","","0.0474","0.0468","","","0.1571","0.1578","","","","","","1.094","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506576","11.7815","0.0007","10.3316","0.0006","12.8152","0.0008","90","","114.146","0.001","90","","1423.41","0.15","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H21 Cl O2 -","- C16 H21 Cl O2 -","- C64 H84 Cl4 O8 -","4","1","","Harmata, Michael; Lee, Dong Reyoul; Barnes, Charles L.","Stereospecific synthesis of dienones via a torquoselective retro-Nazarov reaction.","Organic letters","2005","7","9","1881","1883","10.1021/ol050657v","","","0.71073","MoKα","","0.0409","0.034","","","0.0869","0.0911","","","","","","1.043","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506577","7.5148","0.0007","21.084","0.002","10.2821","0.001","90","","108.583","0.002","90","","1544.2","0.3","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H23 Cl O2 -","- C17 H23 Cl O2 -","- C68 H92 Cl4 O8 -","4","1","","Harmata, Michael; Lee, Dong Reyoul; Barnes, Charles L.","Stereospecific synthesis of dienones via a torquoselective retro-Nazarov reaction.","Organic letters","2005","7","9","1881","1883","10.1021/ol050657v","","","0.71073","MoKα","","0.0566","0.0403","","","0.0893","0.0961","","","","","","1.026","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506578","6.5285","0.0008","10.708","0.0014","16.894","0.002","101.409","0.002","100.481","0.002","94.819","0.002","1129.5","0.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H38 O2 Si -","- C25 H38 O2 Si -","- C50 H76 O4 Si2 -","2","1","","Zimmerman, Howard E.; Cheng, Jie","Control of proton transfer: intramolecular vs intermolecular.","Organic letters","2005","7","13","2595","2597","10.1021/ol0506617","","","0.71073","MoKα","","0.0559","0.0459","","","0.1202","0.1328","","","","","","1.037","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506579","7.724","0.003","8.59","0.003","14.83","0.005","82.446","0.008","77.047","0.007","77.608","0.007","933","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Methyl 5,5-diethoxy-6-(-3-ethoxy-1-nitro-3-oxopropyl)- 2-hydroxycyclohexa-1,3-dienecarboxylate","","- C17 H25 N O9 -","- C17 H25 N O9 -","- C34 H50 N2 O18 -","2","1","","Grecian, Scott; Wrobleski, Aaron D.; Aubé, Jeffrey","Regioselective single and double conjugate additions to substituted cyclohexa-2,5-dienone monoacetals.","Organic letters","2005","7","15","3167","3170","10.1021/ol050715c","","","0.71073","MoKα","","0.0469","0.0415","","","0.1107","0.1154","","","","","","1.054","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506580","8.978","0.003","12.641","0.004","18.581","0.006","80.985","0.007","88.934","0.007","87.825","0.007","2081.1","1.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Methyl 5,5-diethoxy-6-(-3-ethoxy-1-nitro-3-oxopropyl)- 1-methyl-2-oxocyclohex-3-enecarboxylate","","- C18 H27 N O9 -","- C18 H27 N O9 -","- C72 H108 N4 O36 -","4","2","","Grecian, Scott; Wrobleski, Aaron D.; Aubé, Jeffrey","Regioselective single and double conjugate additions to substituted cyclohexa-2,5-dienone monoacetals.","Organic letters","2005","7","15","3167","3170","10.1021/ol050715c","","","0.71073","MoKα","","0.0528","0.0466","","","0.1256","0.1317","","","","","","1.035","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506581","8.672","0.003","9.175","0.003","13.996","0.005","83.3","0.007","76.978","0.007","81.591","0.007","1069.2","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 9,9-diethoxy-3-methyl-7-oxo-6-(phenylcarbamoyl)- 2-oxa-bicyclo[3.3.1]non-3-ene-4-carboxylate","","- C23 H29 N O7 -","- C23 H29 N O7 -","- C46 H58 N2 O14 -","2","1","","Grecian, Scott; Wrobleski, Aaron D.; Aubé, Jeffrey","Regioselective single and double conjugate additions to substituted cyclohexa-2,5-dienone monoacetals.","Organic letters","2005","7","15","3167","3170","10.1021/ol050715c","","","0.71073","MoKα","","0.0414","0.0374","","","0.0961","0.0989","","","","","","1.005","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506582","8.4839","0.0012","11.9599","0.0018","19.058","0.003","74.294","0.003","89.534","0.004","89.004","0.004","1861.3","0.5","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","Ethyl 9,9-dimethoxy-6-(2-nitrophenyl)-3,7- dioxobicyclo[3.3.1]nonane-2-carboxylate","","- C20 H23 N O8 -","- C20 H23 N O8 -","- C80 H92 N4 O32 -","4","2","","Grecian, Scott; Wrobleski, Aaron D.; Aubé, Jeffrey","Regioselective single and double conjugate additions to substituted cyclohexa-2,5-dienone monoacetals.","Organic letters","2005","7","15","3167","3170","10.1021/ol050715c","","","0.71073","MoKα","","0.0443","0.04","","","0.1086","0.1119","","","","","","1.023","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506583","10.5188","0.0012","14.2466","0.0016","14.9179","0.0016","90","","108.088","0.003","90","","2125.1","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Ethyl 9,9-diethoxy-3,7-dioxo-5- (phenylcarbamoyl)bicyclo[3.3.1]nonane-2-carboxylate","","- C23 H29 N O7 -","- C23 H29 N O7 -","- C92 H116 N4 O28 -","4","1","","Grecian, Scott; Wrobleski, Aaron D.; Aubé, Jeffrey","Regioselective single and double conjugate additions to substituted cyclohexa-2,5-dienone monoacetals.","Organic letters","2005","7","15","3167","3170","10.1021/ol050715c","","","0.71073","MoKα","","0.0383","0.0353","","","0.0943","0.0968","","","","","","1.04","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506584","14.9026","0.0016","16.6125","0.0017","7.8304","0.0008","90","","94.235","0.002","90","","1933.3","0.3","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H28 N2 O -","- C22 H28 N2 O -","- C88 H112 N8 O4 -","4","1","","Movassaghi, Mohammad; Schmidt, Michael A.","N-heterocyclic carbene-catalyzed amidation of unactivated esters with amino alcohols.","Organic letters","2005","7","12","2453","2456","10.1021/ol050773y","","","0.71073","MoKα","","0.0637","0.0471","","","0.1036","0.112","","","","","","1.085","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506585","9.871","0.004","10.243","0.004","16.997","0.007","90","","90.397","0.007","90","","1718.5","1.2","173","2","173","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H19 Cl -","- C22 H19 Cl -","- C88 H76 Cl4 -","4","2","","Kabalka, George W.; Yao, Min-Liang; Borella, Scott; Wu, Zhong-Zhi","Substitution of benzylic hydroxyl groups with vinyl moieties using vinylboron dihalides.","Organic letters","2005","7","14","2865","2867","10.1021/ol050778v","","","0.71073","MoKα","","0.0613","0.0501","","","0.1207","0.1313","","","","","","1.029","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506586","6.2725","0.0001","10.1448","0.0003","31.1819","0.0005","90","","90","","90","","1984.21","0.07","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C21 H13 F7 N2 O2 S -","- C21 H13 F7 N2 O2 S -","- C84 H52 F28 N8 O8 S4 -","4","1","","Carreño, M Carmen; García, Isabel; Ribagorda, María; Merino, Estíbaliz; Pieraccini, Silvia; Spada, Gian Piero","Enantiopure sulfinyl azobenzenes as chiroptical switches.","Organic letters","2005","7","14","2869","2872","10.1021/ol050789o","","","1.54178","CuKα","","0.0466","0.0442","","","0.1093","0.1116","","","","","","1.051","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506587","11.739","0.0002","9.94","0.0002","31.993","0.0006","90","","90","","90","","3733.12","0.12","293","2","293","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C18 H30 O6 -","- C18 H30 O6 -","- C144 H240 O48 -","8","1","","Denekamp, C.; Gottlieb, L.; Tamiri, T.; Tsoglin, A.; Shilav, R.; Kapon, M.","Two separable conformers of TATP and analogues exist at room temperature.","Organic letters","2005","7","12","2461","2464","10.1021/ol050801c","","","0.71073","MoKα","","0.0654","0.0378","","","0.0936","0.0989","","","","","","0.886","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506588","10.937","0.004","11.046","0.004","16.161","0.006","88.315","0.007","79.184","0.008","88.986","0.008","1916.8","1.2","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H24 N2 O -","- C23 H24 N2 O -","- C92 H96 N8 O4 -","4","2","","Clayden, Jonathan; Turner, Hazel; Pickworth, Mark; Adler, Thomas","Ring-selective functionalization of N,N'-diarylureas by regioselective N-alkylation and directed ortho metalation.","Organic letters","2005","7","15","3147","3150","10.1021/ol0508025","","","0.71073","MoKα","","0.1865","0.0634","","","0.1321","0.1646","","","","","","0.761","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506589","13.118","0.003","31.435","0.008","7.245","0.001","90","","90","","90","","2987.6","1.1","290","2","290","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C31 H54 O3 -","- C31 H52 O3 -","- C124 H208 O12 -","4","1","","Cai, Xiang-Hai; Luo, Xiao-Dong; Zhou, Jun; Hao, Xiao-Jiang","Compound representatives of a new type of triterpenoid from Aglaia odorata.","Organic letters","2005","7","14","2877","2879","10.1021/ol050805h","","","0.71073","MoKα","","0.1609","0.0621","","","0.1272","0.1451","","","","","","0.94","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506590","15.6736","0.0016","11.2374","0.0011","28.466","0.003","90","","103.342","0.002","90","","4878.4","0.9","173","2","173","2","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C53 H53 Cl O4 P2 Pd Si2 -","- C53 H53 Cl O4 P2 Pd Si2 -","- C212 H212 Cl4 O16 P8 Pd4 Si8 -","4","2","","Ogasawara, Masamichi; Ngo, Helen L.; Sakamoto, Takeshi; Takahashi, Tamotsu; Lin, Wenbin","Applications of 4,4'-(Me3Si)2-BINAP in transition-metal-catalyzed asymmetric carbon-carbon bond-forming reactions.","Organic letters","2005","7","14","2881","2884","10.1021/ol050834s","","","0.71073","MoKα","","0.1299","0.081","","","0.1231","0.1399","","","","","","1.054","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506591","10.692","0.004","11.712","0.005","16.162","0.006","91.492","0.008","99.888","0.008","99.806","0.008","1961.5","1.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C19 H3 F15 O Si -","- C19 H3 F15 O Si -","- C76 H12 F60 O4 Si4 -","4","2","","Dilman, Alexander D.; Belyakov, Pavel A.; Korlyukov, Alexander A.; Struchkova, Marina I.; Tartakovsky, Vladimir A.","Synthesis of pentafluorophenylmethylamines via silicon Mannich reaction.","Organic letters","2005","7","14","2913","2915","10.1021/ol050845l","","","0.71073","MoKα","","0.0666","0.0474","","","0.102","0.111","","","","","","1.027","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506592","6.1898","0.0011","13.115","0.002","18.506","0.003","90","","90","","90","","1502.3","0.4","120","2","120","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C17 H14 F5 N O -","- C17 H14 F5 N O -","- C68 H56 F20 N4 O4 -","4","1","","Dilman, Alexander D.; Belyakov, Pavel A.; Korlyukov, Alexander A.; Struchkova, Marina I.; Tartakovsky, Vladimir A.","Synthesis of pentafluorophenylmethylamines via silicon Mannich reaction.","Organic letters","2005","7","14","2913","2915","10.1021/ol050845l","","","0.71073","MoKα","","0.0709","0.0527","","","0.1112","0.1178","","","","","","0.991","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506593","16.846","0.008","18.842","0.008","11.732","0.005","90","","121.761","0.005","90","","3166","2","273","2","273","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C17 H26 O4 -","- C17 H26 O4 -","- C136 H208 O32 -","8","1","","Li, Wei-Dong Z; Gao, Zhang-Hua","A novel stereocontrolled approach to eudesmanolides: total synthesis of (+/-)-gallicadiol and (+/-)-isogallicadiol.","Organic letters","2005","7","14","2917","2920","10.1021/ol050850p","","","0.71073","MoKα","","0.0475","0.0375","","","0.0988","0.1048","","","","","","1.055","","","","has coordinates","194547","2020-10-21","18:00:00",""
"1506594","9.757","0.009","10.998","0.008","16.41","0.02","98.73","0.08","91.47","0.07","101.8","0.07","1701","3","93.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C31 H53 B F4 I O6 -","- C31 H30 B F4 I O6 -","- C62 H60 B2 F8 I2 O12 -","2","1","","Ochiai, Masahito; Suefuji, Takashi; Miyamoto, Kazunori; Shiro, Motoo","Effects of complexation with 18-crown-6 on the hypernucleofugality of phenyl-lambda3-iodanyl groups. Synthesis of vinyl-lambda3-iodane.18-crown-6 complex.","Organic letters","2005","7","14","2893","2896","10.1021/ol050858z","","","0.7107","MoKα","","","0.083","","","","0.22","","","","","","1.472","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506595","7.8623","0.0001","15.1731","0.0002","17.1191","0.0003","74.7278","0.0007","85.9386","0.0007","84.9098","0.0007","1959.95","0.05","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C46 H50 N2 Si -","- C46 H50 N2 Si2 -","- C92 H100 N4 Si4 -","2","1","","Swartz, Christopher R.; Parkin, Sean R.; Bullock, Joseph E.; Anthony, John E.; Mayer, Alex C.; Malliaras, George G.","Synthesis and characterization of electron-deficient pentacenes.","Organic letters","2005","7","15","3163","3166","10.1021/ol050872b","","","0.71073","MoKα","","0.074","0.0611","","","0.1396","0.1438","","","","","","1.234","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506596","25.6777","0.0006","7.359","0.0002","22.1035","0.0006","90","","97.9757","0.0012","90","","4136.32","0.19","90","0.2","90","0.2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C48 H50 N4 Si2 -","- C48 H50 N4 Si2 -","- C192 H200 N16 Si8 -","4","0.5","","Swartz, Christopher R.; Parkin, Sean R.; Bullock, Joseph E.; Anthony, John E.; Mayer, Alex C.; Malliaras, George G.","Synthesis and characterization of electron-deficient pentacenes.","Organic letters","2005","7","15","3163","3166","10.1021/ol050872b","","","0.71073","MoKα","","0.1084","0.0506","","","0.1043","0.1235","","","","","","1.019","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506597","9.1268","0.0002","13.829","0.0003","16.6202","0.0004","72.3531","0.001","83.9322","0.0009","87.7702","0.0009","1987.75","0.08","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H52 Br2 Si2 -","- C44 H52 Br2 Si2 -","- C88 H104 Br4 Si4 -","2","1","","Swartz, Christopher R.; Parkin, Sean R.; Bullock, Joseph E.; Anthony, John E.; Mayer, Alex C.; Malliaras, George G.","Synthesis and characterization of electron-deficient pentacenes.","Organic letters","2005","7","15","3163","3166","10.1021/ol050872b","","","0.71073","MoKα","","0.0842","0.049","","","0.1126","0.1268","","","","","","1.021","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506598","7.5485","0.0002","7.7478","0.0003","16.8801","0.0006","89.4411","0.0013","78.6534","0.0014","87.0802","0.0012","966.67","0.06","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H50 F4 Si2 -","- C44 H50 F4 Si2 -","- C44 H50 F4 Si2 -","1","0.5","","Swartz, Christopher R.; Parkin, Sean R.; Bullock, Joseph E.; Anthony, John E.; Mayer, Alex C.; Malliaras, George G.","Synthesis and characterization of electron-deficient pentacenes.","Organic letters","2005","7","15","3163","3166","10.1021/ol050872b","","","0.71073","MoKα","","0.0988","0.0711","","","0.1669","0.1768","","","","","","1.622","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506599","7.7182","0.0003","15.5451","0.0005","16.8752","0.0007","102.247","0.0014","92.6664","0.0015","91.5455","0.0015","1975.07","0.13","90","0.2","90","0.2","","","","","","","","4","P -1","-P 1","2","","","","- C44 H46 F8 Si2 -","- C44 H46 F8 Si2 -","- C88 H92 F16 Si4 -","2","1","","Swartz, Christopher R.; Parkin, Sean R.; Bullock, Joseph E.; Anthony, John E.; Mayer, Alex C.; Malliaras, George G.","Synthesis and characterization of electron-deficient pentacenes.","Organic letters","2005","7","15","3163","3166","10.1021/ol050872b","","","0.71073","MoKα","","0.1176","0.062","","","0.1439","0.1681","","","","","","1.019","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506600","8.675","0.0002","17.632","0.0004","14.657","0.0003","90","","105.824","0.0008","90","","2156.94","0.08","90","0.2","90","0.2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 Br4 Si2 -","- C44 H50 Br4 Si2 -","- C88 H100 Br8 Si4 -","2","0.5","","Swartz, Christopher R.; Parkin, Sean R.; Bullock, Joseph E.; Anthony, John E.; Mayer, Alex C.; Malliaras, George G.","Synthesis and characterization of electron-deficient pentacenes.","Organic letters","2005","7","15","3163","3166","10.1021/ol050872b","","","0.71073","MoKα","","0.1068","0.0575","","","0.1342","0.1533","","","","","","1.024","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506601","7.5381","0.0009","8.2908","0.001","17.803","0.002","90","","90","","90","","1112.6","0.2","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H15 N O4 -","- C10 H15 N O4 -","- C40 H60 N4 O16 -","4","1","","Reddy, Leleti Rajender; Saravanan, P.; Fournier, Jean-François; Subba Reddy, B. V.; Corey, E. J.","Simple enantiospecific syntheses of the C(2)-diastereomers of omuralide and 3-methylomuralide.","Organic letters","2005","7","13","2703","2705","10.1021/ol050874w","","","0.71073","MoKα","","0.0419","0.0367","","","0.0995","0.1019","","","","","","1.067","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506602","6.4186","0.001","11.8863","0.0013","31.835","0.003","90","","90","","90","","2428.8","0.5","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","[(2S,4S,5R)-5-phenyl-4-(phenylsulfonyl) tetrahydro-2-furanyl]methyl (-)-camphanate","[(2S,4S,5R)-5-phenyl-4-(phenylsulfonyl)tetrahydro-2-furanyl] methyl(1S,4R)-4,7,7-trimethyl-3-oxo-2-oxabicyclo [2.2.1]heptane-1-carboxylate","","- C27 H30 O7 S -","- C27 H30 O7 S -","- C108 H120 O28 S4 -","4","1","","Makosza, Mieczysław; Barbasiewicz, Michał; Krajewski, Dariusz","Diastereoselective synthesis of tetrahydrofurans via reaction of gamma,delta-epoxycarbanions with aldehydes.","Organic letters","2005","7","14","2945","2948","10.1021/ol0509080","","","0.71073","MoKα","","0.052","0.0383","","","0.0676","0.0718","","","","","","0.962","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506603","6.0067","0.0004","11.6597","0.001","35.632","0.005","90","","90","","90","","2495.5","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","[(2S,4R,5S)-5-phenyl-4-(phenylsulfonyl) tetrahydro-2-furanyl]methyl (-)-camphanate","[(2S,4R,5S)-5-phenyl-4-(phenylsulfonyl)tetrahydro-2-furanyl] methyl (1S,4R)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1] heptane-1-carboxylate","","- C27 H30 O7 S -","- C27 H30 O7 S -","- C108 H120 O28 S4 -","4","1","","Makosza, Mieczysław; Barbasiewicz, Michał; Krajewski, Dariusz","Diastereoselective synthesis of tetrahydrofurans via reaction of gamma,delta-epoxycarbanions with aldehydes.","Organic letters","2005","7","14","2945","2948","10.1021/ol0509080","","","1.54184","CuKα","","0.1378","0.0553","","","0.1235","0.1545","","","","","","1.025","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506604","22.936","0.0005","9.075","0.0002","21.087","0.0006","90","","111.338","0.001","90","","4088.26","0.17","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C23 H19 Br O3 S -","- C23 H19 Br O3 S -","- C184 H152 Br8 O24 S8 -","8","1","","Yamaguchi, Torahiko; Yamamoto, Yohsuke; Fujiwara, Yoshihisa; Tanimoto, Yoshifumi","Evidence for a transition state model compound of in-plane vinylic SN2 reaction.","Organic letters","2005","7","13","2739","2742","10.1021/ol050961o","","","0.71069","MoKα","","0.0906","0.0666","","","0.2392","0.2594","","","","","","2.005","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506605","14.1517","0.0004","11.8995","0.0003","24.3178","0.0005","90","","92.786","0.001","90","","4090.23","0.18","140","1","140","1","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C57 H38 N4 Zn -","- C57.1 H30.25 N4 Zn -","- C228.4 H121 N16 Zn4 -","4","1","","Cammidge, Andrew N.; Scaife, Peter J.; Berber, Gûlen; Hughes, David L.","Cofacial porphyrin-ferrocene dyads and a new class of conjugated porphyrin.","Organic letters","2005","7","16","3413","3416","10.1021/ol050962g","","x-ray","0.71073","MoKα","","0.0574","0.0418","","","0.1052","0.1157","","","","","","1.038","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506606","7.566","0.0014","12.748","0.002","13.632","0.003","90","","90","","90","","1314.8","0.4","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 O6 -","- C14 H16 O6 -","- C56 H64 O24 -","4","1","","Koo, Bonsuk; McDonald, Frank E.","Synthesis of the branched C-glycoside substructure of altromycin B.","Organic letters","2005","7","17","3621","3624","10.1021/ol050975u","","","1.54178","CuKα","","0.0366","0.0336","","","0.0814","0.0842","","","","","","1.148","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506607","8.2807","0.0005","12.6741","0.0008","15.0669","0.0009","90","","90","","90","","1581.28","0.17","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 O7 -","- C16 H22 O7 -","- C64 H88 O28 -","4","1","","Koo, Bonsuk; McDonald, Frank E.","Synthesis of the branched C-glycoside substructure of altromycin B.","Organic letters","2005","7","17","3621","3624","10.1021/ol050975u","","","0.71073","MoKα","","0.0408","0.0375","","","0.0835","0.0849","","","","","","1.012","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506608","8.7351","0.0007","18.9978","0.0016","18.1131","0.0016","90","","95.539","0.002","90","","2991.8","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","(1-(2-nitrobenzyl)-1,4,8,11-tetraaza-cyclotetradecane)nickel(II)ditriflate","","- C20 H33 F6 N5 Ni O9 S2 -","- C20 H33 F6 N5 Ni O9 S2 -","- C80 H132 F24 N20 Ni4 O36 S8 -","4","1","","Boiocchi, Massimo; Fabbrizzi, Luigi; Foti, Francesco; Monzani, Enrico; Poggi, Antonio","Dramatically enhanced carbon acidity of the nitrobenzyl fragment in a nickel(II) scorpionate complex.","Organic letters","2005","7","16","3417","3420","10.1021/ol050981q","","","0.71073","MoKα","","0.0976","0.0859","","","0.2033","0.2099","","","","","","1.224","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506609","7.1606","0.0001","8.5952","0.0001","11.1713","0.0001","90","","103.787","0.001","90","","667.748","0.014","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H14 I N O -","- C14 H14 I N O -","- C28 H28 I2 N2 O2 -","2","1","","King, H. Dalton; Meng, Zhaoxing; Denhart, Derek; Mattson, Ronald; Kimura, Roy; Wu, Dedong; Gao, Qi; Macor, John E.","Enantioselective synthesis of a highly potent selective serotonin reuptake inhibitor. An application of imidazolidinone catalysis to the alkylation of indoles with an alpha,beta-disubstituted alpha,beta-unsaturated aldehyde.","Organic letters","2005","7","16","3437","3440","10.1021/ol051000c","","","1.54178","CuKα","","0.0795","0.0792","","","0.2106","0.2115","","","","","","1.06","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506610","9.0617","0.0001","9.9837","0.0001","18.1625","0.0002","90","","90","","90","","1643.15","0.03","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H22 Cl N3 -","- C17 H22 Cl N3 -","- C68 H88 Cl4 N12 -","4","1","","King, H. Dalton; Meng, Zhaoxing; Denhart, Derek; Mattson, Ronald; Kimura, Roy; Wu, Dedong; Gao, Qi; Macor, John E.","Enantioselective synthesis of a highly potent selective serotonin reuptake inhibitor. An application of imidazolidinone catalysis to the alkylation of indoles with an alpha,beta-disubstituted alpha,beta-unsaturated aldehyde.","Organic letters","2005","7","16","3437","3440","10.1021/ol051000c","","","1.54178","CuKα","","0.0275","0.0272","","","0.0743","0.0746","","","","","","1.056","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506611","10.0462","0.0007","5.387","0.0004","19.6191","0.0014","90","","100.504","0.002","90","","1043.97","0.13","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H23 Br O5 -","- C23 H23 Br O5 -","- C46 H46 Br2 O10 -","2","1","","Su, Shun; Acquilano, Dayle E.; Arumugasamy, Jeevanandam; Beeler, Aaron B.; Eastwood, Erin L.; Giguere, Joshua R.; Lan, Ping; Lei, Xiaoguang; Min, Geanna K.; Yeager, Adam R.; Zhou, Ya; Panek, James S.; Snyder, John K.; Schaus, Scott E.; Porco, Jr, John A","Convergent synthesis of a complex oxime library using chemical domain shuffling.","Organic letters","2005","7","13","2751","2754","10.1021/ol051023r","","","0.71073","MoKα","","0.0539","0.0384","","","0.0819","0.0869","","","","","","0.964","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506612","13.2845","0.0006","7.8086","0.0004","15.4619","0.0007","90","","101.82","0.001","90","","1569.91","0.13","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H17 Cl2 N O5 -","- C15 H17 Cl2 N O5 -","- C60 H68 Cl8 N4 O20 -","4","1","","Su, Shun; Acquilano, Dayle E.; Arumugasamy, Jeevanandam; Beeler, Aaron B.; Eastwood, Erin L.; Giguere, Joshua R.; Lan, Ping; Lei, Xiaoguang; Min, Geanna K.; Yeager, Adam R.; Zhou, Ya; Panek, James S.; Snyder, John K.; Schaus, Scott E.; Porco, Jr, John A","Convergent synthesis of a complex oxime library using chemical domain shuffling.","Organic letters","2005","7","13","2751","2754","10.1021/ol051023r","","","0.71073","MoKα","","0.0646","0.0538","","","0.1591","0.1665","","","","","","1.275","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506613","7.2933","0.001","8.2345","0.0012","24.418","0.003","90","","90","","90","","1466.5","0.3","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H15 N3 O5 -","- C16 H15 N3 O5 -","- C64 H60 N12 O20 -","4","1","","Su, Shun; Acquilano, Dayle E.; Arumugasamy, Jeevanandam; Beeler, Aaron B.; Eastwood, Erin L.; Giguere, Joshua R.; Lan, Ping; Lei, Xiaoguang; Min, Geanna K.; Yeager, Adam R.; Zhou, Ya; Panek, James S.; Snyder, John K.; Schaus, Scott E.; Porco, Jr, John A","Convergent synthesis of a complex oxime library using chemical domain shuffling.","Organic letters","2005","7","13","2751","2754","10.1021/ol051023r","","","0.71073","MoKα","","0.085","0.0519","","","0.0941","0.1045","","","","","","1.027","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506614","10.616","0.003","6.7014","0.0018","10.72","0.003","90","","98.568","0.002","90","","754.1","0.4","143","1","143","1","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H23 N O S2 -","- C15 H23 N O S2 -","- C30 H46 N2 O2 S4 -","2","1","","Smith, 3rd, Amos B; Kim, Dae-Shik","Total synthesis of the neotropical poison-frog alkaloid (-)-205B.","Organic letters","2005","7","15","3247","3250","10.1021/ol0510264","","","0.71069","MoKα","","0.0417","0.0365","","","0.0818","0.0873","","","","","","0.998","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506615","10.3309","0.0009","9.9971","0.0009","16.1798","0.0015","90","","93.954","0.001","90","","1667.1","0.3","203","2","203","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 N O3 -","- C20 H23 N O3 -","- C80 H92 N4 O12 -","4","1","","MacKay, James A.; Bishop, Raynauld L.; Rawal, Viresh H.","Rapid synthesis of the N-methylwelwitindolinone skeleton.","Organic letters","2005","7","16","3421","3424","10.1021/ol051043t","","","0.71073","MoKα","","0.0929","0.0914","","","0.1678","0.1684","","","","","","1.49","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506616","11.8337","0.0013","17.2263","0.0018","9.9628","0.001","90","","106.88","0.002","90","","1943.4","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N O5 S -","- C20 H21 N O5 S -","- C80 H84 N4 O20 S4 -","4","1","","Shi, Yong-Ling; Shi, Min","DABCO-catalyzed reaction of allenic esters and ketones with salicyl N-tosylimines: synthesis of highly functionalized chromenes.","Organic letters","2005","7","14","3057","3060","10.1021/ol051044l","","","0.71073","MoKα","","0.1008","0.0642","","","0.1617","0.1801","","","","","","0.921","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506617","15.9518","0.0012","12.6973","0.0009","19.0989","0.0013","90","","90","","90","","3868.4","0.5","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H21 N O5 S -","- C20 H21 N O5 S -","- C160 H168 N8 O40 S8 -","8","1","","Shi, Yong-Ling; Shi, Min","DABCO-catalyzed reaction of allenic esters and ketones with salicyl N-tosylimines: synthesis of highly functionalized chromenes.","Organic letters","2005","7","14","3057","3060","10.1021/ol051044l","","","0.71073","MoKα","","0.0523","0.0435","","","0.1235","0.129","","","","","","1.069","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506618","6.1618","0.0002","32.2387","0.001","13.1435","0.0004","90","","90.552","0.002","90","","2610.81","0.14","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H36 O12 -","- C25 H36 O12 -","- C100 H144 O48 -","4","2","","Harding, Wayne W.; Tidgewell, Kevin; Schmidt, Matthew; Shah, Kushal; Dersch, Christina M.; Snyder, John; Parrish, Damon; Deschamps, Jeffrey R.; Rothman, Richard B.; Prisinzano, Thomas E.","Salvinicins A and B, new neoclerodane diterpenes from Salvia divinorum.","Organic letters","2005","7","14","3017","3020","10.1021/ol0510522","","","1.54178","CuKα","","0.074","0.0654","","","0.1755","0.1854","","","","","","1.027","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506619","6.3731","0.0006","18.988","0.002","21.365","0.002","90","","90","","90","","2585.4","0.4","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H28 Cl2 O8 -","- C28 H28 Cl2 O8 -","- C112 H112 Cl8 O32 -","4","1","","Harding, Wayne W.; Tidgewell, Kevin; Schmidt, Matthew; Shah, Kushal; Dersch, Christina M.; Snyder, John; Parrish, Damon; Deschamps, Jeffrey R.; Rothman, Richard B.; Prisinzano, Thomas E.","Salvinicins A and B, new neoclerodane diterpenes from Salvia divinorum.","Organic letters","2005","7","14","3017","3020","10.1021/ol0510522","","","1.54178","CuKα","","0.0882","0.0579","","","0.147","0.1677","","","","","","0.997","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506620","16.412","0.001","5.944","0.001","14.762","0.001","90","","95.14","0.01","90","","1434.3","0.3","223","2","223","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C15 H23 N O -","- C15 H23 N O -","- C60 H92 N4 O4 -","4","1","","Bilke, Julia Luzia; Dzuganova, Monika; Fröhlich, Roland; Würthwein, Ernst-Ulrich","Diastereoselective one-step synthesis of functionalized cis-aziridinyl alcohols from oxiranyl carbaldimines.","Organic letters","2005","7","15","3267","3270","10.1021/ol051090l","","","1.54178","CuKα","","0.0493","0.0453","","","0.1278","0.1315","","","","","","1.094","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506621","12.564","0.001","17.312","0.002","15.925","0.001","90","","93.98","0.01","90","","3455.5","0.5","223","2","223","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H23 N O -","- C19 H23 N O -","- C152 H184 N8 O8 -","8","2","","Bilke, Julia Luzia; Dzuganova, Monika; Fröhlich, Roland; Würthwein, Ernst-Ulrich","Diastereoselective one-step synthesis of functionalized cis-aziridinyl alcohols from oxiranyl carbaldimines.","Organic letters","2005","7","15","3267","3270","10.1021/ol051090l","","","1.54178","CuKα","","0.0768","0.0489","","","0.1373","0.1589","","","","","","1.018","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506622","10.981","0.002","11.422","0.002","13.65","0.002","86.71","0.01","68.26","0.01","76.87","0.01","1548","0.5","223","2","223","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H25 N O -","- C16 H25 N O -","- C64 H100 N4 O4 -","4","2","","Bilke, Julia Luzia; Dzuganova, Monika; Fröhlich, Roland; Würthwein, Ernst-Ulrich","Diastereoselective one-step synthesis of functionalized cis-aziridinyl alcohols from oxiranyl carbaldimines.","Organic letters","2005","7","15","3267","3270","10.1021/ol051090l","","","1.54178","CuKα","","0.0464","0.0436","","","0.116","0.1193","","","","","","1.044","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506623","5.9338","0.0005","8.0456","0.0007","24.269","0.002","90","","90","","90","","1158.63","0.17","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","04359","","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C52 H52 N4 O8 -","4","1","","Shen, Lichun; Hsung, Richard P.; Zhang, Yanshi; Antoline, Jennifer E.; Zhang, Xuejun","Copper-catalyzed stereospecific N-allenylations of amides. Syntheses of optically enriched chiral allenamides.","Organic letters","2005","7","14","3081","3084","10.1021/ol051094q","","","0.71073","MoKα","","0.0496","0.0361","","","0.0809","0.0869","","","","","","1.039","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506624","12.8162","0.0014","12.8977","0.0011","16.356","0.0015","90","","109.913","0.007","90","","2542","0.4","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 O5 -","- C30 H28 O5 -","- C120 H112 O20 -","4","1","","Andrus, Merritt B.; Liu, Jing; Ye, Zhifeng; Cannon, John F.","Asymmetric glycolate aldol reactions using cinchonium phase-transfer catalysts.","Organic letters","2005","7","18","3861","3864","10.1021/ol051096a","","","0.71073","MoKα","","0.096","0.0511","","","0.1101","0.1293","","","","","","0.994","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506625","8.8004","0.0003","12.0028","0.0004","26.0589","0.0008","90","","90","","90","","2752.59","0.16","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C32 H30 O6 -","- C32 H30 O6 -","- C128 H120 O24 -","4","1","","Andrus, Merritt B.; Liu, Jing; Ye, Zhifeng; Cannon, John F.","Asymmetric glycolate aldol reactions using cinchonium phase-transfer catalysts.","Organic letters","2005","7","18","3861","3864","10.1021/ol051096a","","","1.54178","CuKα","","0.0624","0.0323","","","0.0823","0.116","","","","","","1.281","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506626","9.8452","0.0002","10.5613","0.0003","14.8694","0.0005","104.192","0.002","91.189","0.002","104.922","0.001","1442.54","0.07","296","2","296","2","","","","","","","","3","P -1","-P 1","2","","","","- C36 H32 O5 -","- C36 H32 O5 -","- C72 H64 O10 -","2","1","","Andrus, Merritt B.; Liu, Jing; Ye, Zhifeng; Cannon, John F.","Asymmetric glycolate aldol reactions using cinchonium phase-transfer catalysts.","Organic letters","2005","7","18","3861","3864","10.1021/ol051096a","","","1.54178","CuKα","","0.0816","0.0696","","","0.1838","0.1961","","","","","","1.054","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506627","12.2933","0.0004","12.9966","0.0004","15.9109","0.0006","90","","109.518","0.002","90","","2396.02","0.14","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 O6 -","- C28 H26 O6 -","- C112 H104 O24 -","4","1","","Andrus, Merritt B.; Liu, Jing; Ye, Zhifeng; Cannon, John F.","Asymmetric glycolate aldol reactions using cinchonium phase-transfer catalysts.","Organic letters","2005","7","18","3861","3864","10.1021/ol051096a","","","1.54178","CuKα","","0.0454","0.041","","","0.1198","0.1225","","","","","","1.063","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506628","8.3834","0.0005","18.8291","0.0011","10.2686","0.0006","90","","98.088","0.001","90","","1604.79","0.16","173","2","173","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C27 H51 Cl N4 O7 Rh2 -","- C27 H51 Cl N4 O7 Rh2 -","- C54 H102 Cl2 N8 O14 Rh4 -","2","1","","Catino, Arthur J.; Nichols, Jason M.; Forslund, Raymond E.; Doyle, Michael P.","Efficient aziridination of olefins catalyzed by mixed-valent dirhodium(II,III) caprolactamate.","Organic letters","2005","7","13","2787","2790","10.1021/ol0510973","","","0.71073","MoKα","","0.0334","0.0267","","","0.0597","0.0623","","","","","","1.029","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506629","9.322","0.003","28.033","0.01","25.438","0.009","90","","92.491","0.008","90","","6641","4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H28 Cl2 Se -","- C38 H28 Cl2 Se -","- C304 H224 Cl16 Se8 -","8","2","","Shi, Min; Liu, Le-Ping; Tang, Jie","Enynylation of 2-iodo-4-(phenylchalcogenyl)-1-butenes via intramolecular chelation: approach to the synthesis of conjugated dienynes or trienynes.","Organic letters","2005","7","14","3085","3088","10.1021/ol051101a","","","0.71073","MoKα","","0.2273","0.085","","","0.2072","0.2479","","","","","","0.808","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506630","11.602","0.002","10.937","0.002","13.353","0.003","90","","91.68","0.03","90","","1693.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C15 H20 N2 O4 S -","- C15 H20 N2 O4 S -","- C60 H80 N8 O16 S4 -","4","1","","Shi, Weifeng; Zhang, Bo; Zhang, Jian; Liu, Binge; Zhang, Shiwei; Wang, Jianbo","Stereoselective intramolecular 1,3 C-H insertion in Rh(II) carbene reactions.","Organic letters","2005","7","14","3103","3106","10.1021/ol051130l","","","0.71073","MoKα","","0.0827","0.0425","","","0.0914","0.0989","","","","","","0.928","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506631","9.3162","0.0019","17.8","0.004","9.36","0.0019","90","","107.19","0.03","90","","1482.8","0.6","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H18 O4 S -","- C14 H18 O4 S -","- C56 H72 O16 S4 -","4","1","","Shi, Weifeng; Zhang, Bo; Zhang, Jian; Liu, Binge; Zhang, Shiwei; Wang, Jianbo","Stereoselective intramolecular 1,3 C-H insertion in Rh(II) carbene reactions.","Organic letters","2005","7","14","3103","3106","10.1021/ol051130l","","","0.71073","MoKα","","0.0868","0.054","","","0.1576","0.1729","","","","","","1.003","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506632","9.0592","0.0018","9.6194","0.0019","12.332","0.003","94.17","0.03","104.87","0.03","117.63","0.03","896.9","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H24 O4 S -","- C18 H24 O4 S -","- C36 H48 O8 S2 -","2","1","","Shi, Weifeng; Zhang, Bo; Zhang, Jian; Liu, Binge; Zhang, Shiwei; Wang, Jianbo","Stereoselective intramolecular 1,3 C-H insertion in Rh(II) carbene reactions.","Organic letters","2005","7","14","3103","3106","10.1021/ol051130l","","","0.71073","MoKα","","0.0652","0.0459","","","0.1275","0.1348","","","","","","1.049","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506633","8.9507","0.0008","25.614","0.002","30.16","0.003","90","","90","","90","","6914.6","1.1","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H19 Br O -","- C16 H19 Br O -","- C320 H380 Br20 O20 -","20","5","","Li, Wei-Dong Z; Yang, Yu-Rong","Unusual cyclopropanation of 9-bromocamphor derivatives: a novel formal C(1)-C(7) bond cleavage of camphor.","Organic letters","2005","7","14","3107","3110","10.1021/ol051141e","","","0.71073","MoKα","","0.1065","0.0427","","","0.0541","0.0628","","","","","","0.908","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506634","7.2349","0.0015","7.3055","0.0015","44.21","0.009","90","","90","","90","","2336.7","0.8","213","2","213","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H19 Br O2 -","- C11 H19 Br O2 -","- C88 H152 Br8 O16 -","8","2","","Li, Wei-Dong Z; Yang, Yu-Rong","Unusual cyclopropanation of 9-bromocamphor derivatives: a novel formal C(1)-C(7) bond cleavage of camphor.","Organic letters","2005","7","14","3107","3110","10.1021/ol051141e","","","0.71073","MoKα","","0.0921","0.0647","","","0.1417","0.149","","","","","","1.084","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506635","8.333","0.002","9.435","0.002","17.078","0.004","100.347","0.004","94.628","0.004","106.942","0.004","1250.9","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","1a","","","- C25 H14 F6 S6 -","- C25 H14 F6 S6 -","- C50 H28 F12 S12 -","2","1","","Moriyama, Yoshihisa; Matsuda, Kenji; Tanifuji, Naoki; Irie, Setsuko; Irie, Masahiro","Electrochemical cyclization/cycloreversion reactions of diarylethenes.","Organic letters","2005","7","15","3315","3318","10.1021/ol051149o","","","0.71073","MoKα","","0.0963","0.0772","","","0.2052","0.2237","","","","","","1.011","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506636","6.3088","0.0002","12.2906","0.0007","15.0145","0.0009","90","","90","","90","","1164.21","0.1","200","1","200","1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H20 O -","- C14 H20 O -","- C56 H80 O4 -","4","1","","Mazzola, Jr, Robert D; White, Timothy D.; Vollmer-Snarr, Heidi R; West, F. G.","Stereoselective Nazarov cyclizations of bridged bicyclic dienones.","Organic letters","2005","7","13","2799","2801","10.1021/ol051169q","","","0.71073","MoKα","","0.0814","0.0537","","","0.113","0.1281","","","","","","1.027","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506637","9.3865","0.0008","21.2279","0.0017","18.8177","0.0015","90","","91.394","0.001","90","","3748.4","0.5","167","2","167","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","compound 4 acetone solvate","4,6,16,18,31,33-hexanitro-2,8,14,20,29,35- hexaoxabicyclocalix[4]arene","","- C36 H24 N6 O20 -","- C36 H24 N6 O20 -","- C144 H96 N24 O80 -","4","0.5","","Katz, Jeffrey L.; Selby, Kevin J.; Conry, Rebecca R.","Single-step synthesis of D3h-symmetric bicyclooxacalixarenes.","Organic letters","2005","7","16","3505","3507","10.1021/ol051180q","","","0.71073","MoKα","","0.0627","0.0559","","","0.1647","0.1712","","","","","","1.071","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506638","15.8519","0.0011","11.8209","0.0008","21.1429","0.0015","90","","105.66","0.001","90","","3814.8","0.5","167","2","167","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","compound 10 ethyl acetate solvate","4,6,16,18,31,33-hexacyano-25,27,36-triaza- 2,8,14,20,29,35-hexaoxabicyclocalix[4]arene","","- C41 H25 N9 O10 -","- C41 H25 N9 O10 -","- C164 H100 N36 O40 -","4","1","","Katz, Jeffrey L.; Selby, Kevin J.; Conry, Rebecca R.","Single-step synthesis of D3h-symmetric bicyclooxacalixarenes.","Organic letters","2005","7","16","3505","3507","10.1021/ol051180q","","","0.71073","MoKα","","0.0594","0.0519","","","0.1476","0.1536","","","","","","1.074","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506639","14.3969","0.0017","7.248","0.0008","19.347","0.002","90","","111.413","0.002","90","","1879.5","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H20 Cl2 N2 O3 -","- C19 H20 Cl2 N2 O3 -","- C76 H80 Cl8 N8 O12 -","4","1","","Clayden, Jonathan; Hamilton, Stuart D.; Mohammed, Rukhsana T.","Cyclization of lithiated pyridine and quinoline carboxamides: synthesis of partially saturated pyrrolopyridines and spirocyclic beta-lactams.","Organic letters","2005","7","17","3673","3676","10.1021/ol051214u","","","0.71073","MoKα","","0.0565","0.0398","","","0.0914","0.1091","","","","","","0.956","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506640","9.873","0.001","12.734","0.001","13.85","0.002","88.64","0.01","89.51","0.01","86.93","0.01","1738.2","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H34 S4 Si2 -","- C38 H34 S4 Si2 -","- C76 H68 S8 Si4 -","2","1","","Nicolas, Yohann; Blanchard, Philippe; Roncali, Jean; Allain, Magali; Mercier, Nicolas; Deman, Anne-Laure; Tardy, Jacques","Synthesis of a thermally stable hybrid acene-thiophene organic semiconductor via a soluble precursor.","Organic letters","2005","7","16","3513","3516","10.1021/ol051224v","","","0.71073","MoKα","","0.1073","0.0393","","","0.0731","0.0911","","","","","","0.863","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506641","10.464","0.002","20.06","0.002","42.729","0.006","90","","95.82","0.02","90","","8923","2","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H57 S3 Si6 -","- C30 H57 S3 Si6 -","- C240 H456 S24 Si48 -","8","1","","Nicolas, Yohann; Blanchard, Philippe; Roncali, Jean; Allain, Magali; Mercier, Nicolas; Deman, Anne-Laure; Tardy, Jacques","Synthesis of a thermally stable hybrid acene-thiophene organic semiconductor via a soluble precursor.","Organic letters","2005","7","16","3513","3516","10.1021/ol051224v","","","0.71073","MoKα","","0.2826","0.1654","","","0.3702","0.4351","","","","","","0.937","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506642","7.259","0.002","11.372","0.004","12.832","0.006","115.87","0.03","100.92","0.03","95.2","0.03","917.7","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H9 N9 O3 -","- C18 H9 N9 O3 -","- C36 H18 N18 O6 -","2","1","","Chang, Tsu-Hsin; Wu, Bi-Ru; Chiang, Michael Y.; Liao, Su-Chih; Ong, Chi Wi; Hsu, Hsiu-Fu; Lin, Shu-Yu","Synthesis and mesomorphic behavior of a donor-acceptor-type hexaazatriphenylene.","Organic letters","2005","7","19","4075","4078","10.1021/ol051231j","","","0.71073","MoKα","","0.1638","0.0513","","","0.1364","0.1831","","","","","","0.995","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506643","6.2361","0.0012","9.666","0.002","25.314","0.005","90","","90","","90","","1525.9","0.5","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H25 N O5 -","- C14 H25 N O5 -","- C56 H100 N4 O20 -","4","1","","Cren, Sylvaine; Wilson, Claire; Thomas, Neil R.","A rapid synthesis of hexofuranose-like iminosugars using ring-closing metathesis.","Organic letters","2005","7","16","3521","3523","10.1021/ol051232b","","","0.71073","MoKα","","0.059","0.0536","","","0.1374","0.1419","","","","","","1.165","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506644","9.6372","0.0012","12.27","0.002","10.3017","0.0013","90","","91.837","0.002","90","","1217.5","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H17 N O -","- C16 H17 N O -","- C64 H68 N4 O4 -","4","1","","Baudoux, Jérôme; Blake, Alexander J.; Simpkins, Nigel S.","Rapid access to the Welwitindolinone alkaloid skeleton by cyclization of indolecarboxaldehyde substituted cyclohexanones.","Organic letters","2005","7","19","4087","4089","10.1021/ol051239t","","","0.71073","MoKα","","0.0483","0.0428","","","0.12","0.125","","","","","","1.06","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506645","10.4622","0.0016","24.02","0.004","10.5456","0.0017","90","","99.629","0.004","90","","2612.8","0.7","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 N O3 P -","- C30 H28 N O3 P -","- C120 H112 N4 O12 P4 -","4","1","","Wipf, Peter; Pierce, Joshua G.","Synthesis of homoallylic amines by hydrozirconation-imine addition of allenes.","Organic letters","2005","7","16","3537","3540","10.1021/ol051266j","","","0.71073","MoKα","","0.2941","0.2114","","","0.3576","0.399","","","","","","1.156","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506646","10.9347","0.0005","13.4323","0.0006","19.5642","0.0009","90.802","0.001","90.893","0.001","105.947","0.001","2762.1","0.2","295","2","295","2","","","","","","","","6","P -1","-P 1","2","","","","- C28 H36 N O P Si -","- C28 H36 N O P Si -","- C112 H144 N4 O4 P4 Si4 -","4","2","","Wipf, Peter; Pierce, Joshua G.","Synthesis of homoallylic amines by hydrozirconation-imine addition of allenes.","Organic letters","2005","7","16","3537","3540","10.1021/ol051266j","","","0.71073","MoKα","","0.1128","0.0644","","","0.1601","0.1745","","","","","","1.135","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506647","5.52","0.003","8.698","0.004","16.224","0.007","90","","98.12","0.007","90","","771.2","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H12 N2 O3 -","- C7 H12 N2 O3 -","- C28 H48 N8 O12 -","4","1","","Moon, Bongjin; Han, Sangbae; Kim, Dohyung","Efficient synthesis of highly functionalized cyclic aminimides.","Organic letters","2005","7","15","3359","3361","10.1021/ol051270v","","","0.71073","MoKα","","0.1351","0.0799","","","0.1549","0.1774","","","","","","1.066","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506648","6.8895","0.0014","7.8323","0.0016","16.708","0.004","90","","90","","90","","901.6","0.3","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H11 O4 P -","- C8 H11 O4 P -","- C32 H44 O16 P4 -","4","1","","Whitehead, Alan; McReynolds, Matthew D.; Moore, Joel D.; Hanson, Paul R.","Multivalent activation in temporary phosphate tethers: a new tether for small molecule synthesis.","Organic letters","2005","7","15","3375","3378","10.1021/ol0512886","","","0.71073","MoKα","","0.0296","0.0292","","","0.0994","0.1012","","","","","","1.053","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506649","12.77","0.01","17.9","0.02","9.388","0.005","97.01","0.06","98.04","0.05","98.57","0.07","2079","3","298.1","","","","","","","","","","","5","P -1","-P 1","2","","","","- C40 H54 N2 O4 S4 -","- C40 H54 N2 O4 S4 -","- C80 H108 N4 O8 S8 -","2","1","","Takahashi, Toshiaki; Takimiya, Kazuo; Otsubo, Tetsuo; Aso, Yoshio","Synthesis and spectral properties of a highly soluble push-pull type of quinoidal thiophenes.","Organic letters","2005","7","20","4313","4316","10.1021/ol0513037","","","0.7107","MoKα","","","0.06","","","","0.281","","","","","","0.817","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506650","13.6057","0.0009","19.0409","0.0012","14.9447","0.001","90","","102.454","0.001","90","","3780.5","0.4","190","2","190","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C39 H33 N9 O10 -","- C39 H33 N9 O10 -","- C156 H132 N36 O40 -","4","1","","Degenhardt, 3rd, Charles F; Lavin, Judith M.; Smith, Mark D.; Shimizu, Ken D.","Conformationally imprinted receptors: atropisomers with ""write"", ""save"", and ""erase"" recognition properties.","Organic letters","2005","7","19","4079","4081","10.1021/ol051325t","","","0.71073","MoKα","","0.0654","0.0457","","","0.1016","0.1087","","","","","","1.008","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506651","8.809","0.004","18.028","0.008","10.368","0.005","90","","96.8388","0.0019","90","","1634.8","1.3","120","2","120","2","","","","","","","","6","P 1 21 1","P 2yb","4","5,6-dichloro-2-[2-(phenylazo)phenyl] -1,3,2-Benzodioxaborole","5,6-dichloro-2-[2-(phenylazo)phenyl] -1,3,2-Benzodioxaborole","","- C18 H11 B Cl2 N2 O2 -","- C18 H11 B Cl2 N2 O2 -","- C72 H44 B4 Cl8 N8 O8 -","4","2","","Kano, Naokazu; Yoshino, Junro; Kawashima, Takayuki","Photoswitching of the Lewis acidity of a catecholborane bearing an azo group based on the change in coordination number of boron.","Organic letters","2005","7","18","3909","3911","10.1021/ol051337e","","","0.7107","MoKα","","0.0745","0.0453","","","0.0807","0.0939","","","","","","0.898","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506652","14.5655","0.0005","16.5819","0.0005","7.9981","0.0002","90","","93.485","0.001","90","","1928.16","0.1","295","2","295","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C25 H14 Br2 -","- C25 H14 Br2 -","- C100 H56 Br8 -","4","1","","Chiang, Chih-Long; Shu, Ching-Fong; Chen, Chin-Ti","Improved synthesis of 2,2'-dibromo-9,9'-spirobifluorene and its 2,2'-bisdonor-7,7'-bisacceptor-substituted fluorescent derivatives.","Organic letters","2005","7","17","3717","3720","10.1021/ol0513591","","","0.71073","MoKα","","0.0623","0.0476","","","0.1268","0.1349","","","","","","1.041","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506653","21.018","0.006","8.137","0.003","18.221","0.004","90","","119.049","0.012","90","","2724.2","1.4","153","2","153","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4-(4-methoxy-2,6-dimethyl-phenyl)-3,5-dimethyl-pyridin-1-ol","","- C16 H19 N O2 -","- C16 H19 N O2 -","- C128 H152 N8 O16 -","8","1","","Kang, Hu; Facchetti, Antonio; Stern, Charlotte L.; Rheingold, Arnold L.; Kassel, W. Scott; Marks, Tobin J.","Efficient synthesis and structural characteristics of zwitterionic twisted pi-electron system biaryls.","Organic letters","2005","7","17","3721","3724","10.1021/ol051365x","","","0.71073","MoKα","","0.0653","0.0525","","","0.142","0.1552","","","","","","1.1","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506654","21.927","0.006","29.244","0.004","8.089","0.002","90","","90","","90","","5187","2","153","2","153","2","","","","","","","","4","F d d 2","F 2 -2d","43","","4-(3,5-dimethyl-pyridin-4-yl)-3,5-dimethyl-phenol","","- C15 H17 N O -","- C15 H17 N O -","- C240 H272 N16 O16 -","16","1","","Kang, Hu; Facchetti, Antonio; Stern, Charlotte L.; Rheingold, Arnold L.; Kassel, W. Scott; Marks, Tobin J.","Efficient synthesis and structural characteristics of zwitterionic twisted pi-electron system biaryls.","Organic letters","2005","7","17","3721","3724","10.1021/ol051365x","","","0.71073","MoKα","","0.0431","0.0381","","","0.0982","0.1023","","","","","","1.067","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506655","12.834","0.002","17.241","0.003","7.9026","0.0013","90","","100.799","0.011","90","","1717.6","0.5","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4-(4-Methoxy-2,6-dimethyl-phenyl)-1,3,5-trimethyl-pyridinium iodide","","- C17 H22 I N O -","- C17 H22 I N O -","- C68 H88 I4 N4 O4 -","4","1","","Kang, Hu; Facchetti, Antonio; Stern, Charlotte L.; Rheingold, Arnold L.; Kassel, W. Scott; Marks, Tobin J.","Efficient synthesis and structural characteristics of zwitterionic twisted pi-electron system biaryls.","Organic letters","2005","7","17","3721","3724","10.1021/ol051365x","","","0.71073","MoKα","","0.0381","0.0288","","","0.0659","0.072","","","","","","1.067","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506656","27.251","0.007","11.561","0.0018","11.868","0.003","90","","109.661","0.015","90","","3521","1.4","153","2","153","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","4-(4-Hydroxy-2,6-dimethyl-phenyl)-1,3,5-trimethyl-pyridinium iodide","","- C16 H22 I N O2 -","- C16 H22 I N O2 -","- C128 H176 I8 N8 O16 -","8","1","","Kang, Hu; Facchetti, Antonio; Stern, Charlotte L.; Rheingold, Arnold L.; Kassel, W. Scott; Marks, Tobin J.","Efficient synthesis and structural characteristics of zwitterionic twisted pi-electron system biaryls.","Organic letters","2005","7","17","3721","3724","10.1021/ol051365x","","","0.71073","MoKα","","0.0455","0.032","","","0.0756","0.084","","","","","","1.029","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506657","12.235","0.0007","12.985","0.0007","12.7805","0.0007","90","","110.207","0.0008","90","","1905.48","0.18","153","2","153","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","3,5-dimethyl-4-(1,3,5-trimethyl-1H-pyridin-4-ylidene)-cyclohexa-2,5-Dienone","","- C17 H23 I N Na O2 -","- C17 H23 I N Na O2 -","- C68 H92 I4 N4 Na4 O8 -","4","1","","Kang, Hu; Facchetti, Antonio; Stern, Charlotte L.; Rheingold, Arnold L.; Kassel, W. Scott; Marks, Tobin J.","Efficient synthesis and structural characteristics of zwitterionic twisted pi-electron system biaryls.","Organic letters","2005","7","17","3721","3724","10.1021/ol051365x","","","0.71073","MoKα","","0.0275","0.0236","","","0.0605","0.0634","","","","","","1.026","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506658","14.551","0.002","15.697","0.003","18.554","0.003","90","","103.107","0.002","90","","4127.5","1.2","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","2,6-di-tert-butyl-4-{2-[4-(3,5-dimethyl-1-octyl-1H-pyridin-4-ylidene)-3,5-dimethyl-cyclohexa-2,5-dienylidene]-ethylidene}-cyclohexa-2,5-dienone","","- C42 H64 N O4 -","- C42 H55 N O4 -","- C168 H220 N4 O16 -","4","1","","Kang, Hu; Facchetti, Antonio; Stern, Charlotte L.; Rheingold, Arnold L.; Kassel, W. Scott; Marks, Tobin J.","Efficient synthesis and structural characteristics of zwitterionic twisted pi-electron system biaryls.","Organic letters","2005","7","17","3721","3724","10.1021/ol051365x","","","0.71073","MoKα","","0.0981","0.0788","","","0.2067","0.22","","","","","","1.102","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506659","16.905","0.003","6.1078","0.0007","15.42","0.003","90","","114.336","0.015","90","","1450.7","0.5","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C13 H16 Br N O3 S -","- C13 H16 Br N O3 S -","- C52 H64 Br4 N4 O12 S4 -","4","1","","Yu, Chan-Mo; Youn, Jinsuop; Lee, Min-Kyoung","Regulation of stereoselectivity using Lewis acid in the cyclization of allenic aldehydes catalyzed by palladium complex.","Organic letters","2005","7","17","3733","3736","10.1021/ol0513701","","","0.71073","MoKα","","0.1099","0.0639","","","0.1394","0.1826","","","","","","1.11","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506660","8.446","0.002","12.812","0.003","19.021","0.003","88.816","0.013","83.451","0.018","89.42","0.03","2044.3","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H23 N O4 S -","- C22 H23 N O4 S -","- C88 H92 N4 O16 S4 -","4","2","","Yu, Chan-Mo; Youn, Jinsuop; Lee, Min-Kyoung","Regulation of stereoselectivity using Lewis acid in the cyclization of allenic aldehydes catalyzed by palladium complex.","Organic letters","2005","7","17","3733","3736","10.1021/ol0513701","","","0.71073","MoKα","","0.1163","0.0679","","","0.1679","0.2014","","","","","","1.009","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506661","10.8949","0.0002","12.1414","0.0002","15.7917","0.0003","90","","90","","90","","2088.92","0.07","153","2","153","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H22 O5 -","- C26 H22 O5 -","- C104 H88 O20 -","4","1","","Magnus, Philip; Stent, Matthew A. H.","Stereospecific synthesis of (+/-)-1,2-anhydro methyl rocaglate.","Organic letters","2005","7","18","3853","3855","10.1021/ol0513793","","","0.71073","MoKα","","0.0829","0.0418","","","0.0794","0.0929","","","","","","1.044","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506662","7.115","0.0002","10.4338","0.0004","14.1498","0.0005","89.289","0.002","90.728","0.002","107.279","0.002","1002.9","0.06","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C26 H22 O5 -","- C26 H22 O5 -","- C52 H44 O10 -","2","1","","Magnus, Philip; Stent, Matthew A. H.","Stereospecific synthesis of (+/-)-1,2-anhydro methyl rocaglate.","Organic letters","2005","7","18","3853","3855","10.1021/ol0513793","","","0.71073","MoKα","","0.1239","0.0944","","","0.1541","0.1643","","","","","","1.171","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506663","14.5342","0.0004","11.9275","0.0003","14.7603","0.0003","90","","117.704","0.001","90","","2265.46","0.1","120","1","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 F3 N O4 S Si -","- C20 H26 F3 N O4 S Si -","- C80 H104 F12 N4 O16 S4 Si4 -","4","1","","Eckert, Matthieu; Monnier, Florian; Shchetnikov, Grigorii T.; Titanyuk, Igor D.; Osipov, Serguej N.; Toupet, Loïc; Dérien, Sylvie; Dixneuf, Pierre H.","Tandem catalytic carbene addition/bicyclization of enynes. One-step synthesis of fluorinated bicyclic amino esters by ruthenium catalysis.","Organic letters","2005","7","17","3741","3743","10.1021/ol051393f","","","0.71069","MoKα","","0.1051","0.098","","","0.2564","0.2614","","","","","","1.134","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506664","7.247","0.0002","20.1918","0.0007","9.791","0.0004","90","","104.179","0.002","90","","1389.07","0.08","172","","","","","","","","","","Peters group","5","P 1 21 1","P 2yb","4","","","","- C34 H32 Fe N2 O -","- C34 H32 Fe N2 O -","- C68 H64 Fe2 N4 O2 -","2","1","","Peters, René; Fischer, Daniel F.","Preparation and diastereoselective ortho-metalation of chiral ferrocenyl imidazolines: remarkable influence of LDA as metalation additive.","Organic letters","2005","7","19","4137","4140","10.1021/ol051437k","","","0.71073","MoKα","","0.0786","0.0536","","","0.135","0.1569","","","","","","0.939","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506665","9.8803","0.0002","13.2759","0.0002","20.8422","0.0004","90","","90","","90","","2733.87","0.09","173.2","","","","","","","","","","Peters group","5","P 21 21 21","P 2ac 2ab","19","","","","- C34 H32 Fe N2 O -","- C34 H32 Fe N2 O -","- C136 H128 Fe4 N8 O4 -","4","1","","Peters, René; Fischer, Daniel F.","Preparation and diastereoselective ortho-metalation of chiral ferrocenyl imidazolines: remarkable influence of LDA as metalation additive.","Organic letters","2005","7","19","4137","4140","10.1021/ol051437k","","","0.71073","MoKα","","0.0535","0.0445","","","0.1221","0.1324","","","","","","1.005","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506666","17.946","0.0007","11.4823","0.0005","7.3257","0.0003","90","","90","","90","","1509.54","0.11","87","2","87","2","","","","","","","","4","P c a 21","P 2c -2ac","29","4-Me-Ph-IF2","","","- C7 H7 F2 I -","- C7 H7 F2 I -","- C56 H56 F16 I8 -","8","2","","Ye, Chengfeng; Twamley, Brendan; Shreeve, Jean'ne M.","Straightforward syntheses of hypervalent iodine(III) reagents mediated by Selectfluor.","Organic letters","2005","7","18","3961","3964","10.1021/ol051446t","","","0.71073","MoKα","","0.0232","0.0228","","","0.0568","0.0571","","","","","","1.057","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506667","11.5263","0.0007","12.7649","0.0008","17.7467","0.0011","76.027","0.001","81.454","0.001","88.146","0.001","2505.7","0.3","87","2","87","2","","","","","","","","4","P -1","-P 1","2","F2I-5-tBu-1,3-Me3Ph","","","- C12 H17 F2 I -","- C12 H17 F2 I -","- C96 H136 F16 I8 -","8","4","","Ye, Chengfeng; Twamley, Brendan; Shreeve, Jean'ne M.","Straightforward syntheses of hypervalent iodine(III) reagents mediated by Selectfluor.","Organic letters","2005","7","18","3961","3964","10.1021/ol051446t","","","0.71073","MoKα","","0.0551","0.0485","","","0.1269","0.1325","","","","","","1.032","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506668","7.0914","0.0014","24.615","0.005","6.3857","0.0013","90","","90","","90","","1114.7","0.4","295","2","295","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C12 H11 Br O2 -","- C12 H11 Br O2 -","- C48 H44 Br4 O8 -","4","1","","Kopp, Felix; Sklute, Genia; Polborn, Kurt; Marek, Ilan; Knochel, Paul","Stereoselective functionalization of cyclopropane derivatives using bromine/magnesium and sulfoxide/magnesium exchange reactions.","Organic letters","2005","7","17","3789","3791","10.1021/ol051452p","","","0.71073","MoKα","","0.0556","0.034","","","0.078","0.0916","","","","","","1.052","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506669","10.1973","0.0011","15.796","0.002","7.0016","0.0014","90","","95.581","0.015","90","","1122.4","0.3","295","2","295","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 Br N S -","- C11 H10 Br N S -","- C44 H40 Br4 N4 S4 -","4","1","","Kopp, Felix; Sklute, Genia; Polborn, Kurt; Marek, Ilan; Knochel, Paul","Stereoselective functionalization of cyclopropane derivatives using bromine/magnesium and sulfoxide/magnesium exchange reactions.","Organic letters","2005","7","17","3789","3791","10.1021/ol051452p","","","0.71073","MoKα","","0.0739","0.042","","","0.1044","0.1225","","","","","","1.075","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506670","11.903","0.002","12.782","0.002","18.785","0.003","90.687","0.008","95.682","0.008","96.926","0.008","2822.4","0.8","133","2","133","2","","","","","","","","3","P -1","-P 1","2","","","","- C40.75 H27 Cl0.5 -","- C40.75 H27 Cl0.5 -","- C163 H108 Cl2 -","4","2","","Hinrichs, Heino; Fischer, Axel K.; Jones, Peter G.; Hopf, Henning; Haley, Michael M.","[2.2]paracyclophane/dehydroannulene hybrids: probing the aromaticity of the dehydro[14]annulene framework.","Organic letters","2005","7","17","3793","3795","10.1021/ol0514552","","","0.71073","MoKα","","0.1113","0.0683","","","0.1663","0.1862","","","","","","1.029","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506671","9.3588","0.0008","12.8978","0.0012","28.84","0.003","90","","90","","90","","3481.2","0.6","133","2","133","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C42 H40 Si2 -","- C42 H40 Si2 -","- C168 H160 Si8 -","4","1","","Hinrichs, Heino; Fischer, Axel K.; Jones, Peter G.; Hopf, Henning; Haley, Michael M.","[2.2]paracyclophane/dehydroannulene hybrids: probing the aromaticity of the dehydro[14]annulene framework.","Organic letters","2005","7","17","3793","3795","10.1021/ol0514552","","","0.71073","MoKα","","0.0381","0.0326","","","0.0822","0.0845","","","","","","1.017","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506672","8.5041","0.0016","11.865","0.002","11.568","0.002","90","","103.149","0.003","90","","1136.6","0.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H29 N O4 -","- C28 H29 N O4 -","- C56 H58 N2 O8 -","2","1","","Pallerla, Mahesh K.; Fox, Joseph M.","Diastereoselective intermolecular Pauson-Khand reactions of chiral cyclopropenes.","Organic letters","2005","7","16","3593","3595","10.1021/ol051456u","","","0.71073","MoKα","","0.0444","0.0386","","","0.0863","0.0884","","","","","","1.055","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506673","8.057","0.001","18.472","0.004","12.023","0.002","90","","94.8","0.02","90","","1783.1","0.5","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 F4 N2 O3 -","- C18 H14 F4 N2 O3 -","- C72 H56 F16 N8 O12 -","4","1","","Huang, Shenlin; Pan, Yuanjiang; Zhu, Yulin; Wu, Anxin","A novel three-component one-pot reaction involving alkynes, urea or thiourea, and aldehydes.","Organic letters","2005","7","17","3797","3799","10.1021/ol051458e","","","0.71073","MoKα","","0.1112","0.0529","","","0.1267","0.1405","","","","","","0.949","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506674","26.939","0.001","8.9373","0.0003","18.5928","0.0007","90","","118.072","0.001","90","","3949.8","0.3","295","1","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H18 F4 N2 O3 -","- C20 H18 F4 N2 O3 -","- C160 H144 F32 N16 O24 -","8","1","","Huang, Shenlin; Pan, Yuanjiang; Zhu, Yulin; Wu, Anxin","A novel three-component one-pot reaction involving alkynes, urea or thiourea, and aldehydes.","Organic letters","2005","7","17","3797","3799","10.1021/ol051458e","","","0.7107","MoKα","","","0.087","","","","0.223","","","","","","1.011","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506675","12.705","0.002","19.177","0.003","11.2498","0.0018","90","","94.877","0.003","90","","2731","0.7","153","2","153","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","-1-[6-(1-oxyl-3-oxide-4,4,5,5-tetramethylimidazolin-2-yl) -2-methylbenzo[b]-thiophen-3-yl]- 2-(2-methylbenzo[b]-thiophen-3-yl)hexafluorocyclopentene","","- C30 H25 F6 N2 O2 S2 -","- C30 H25 F6 N2 O2 S2 -","- C120 H100 F24 N8 O8 S8 -","4","1","","Tanifuji, Naoki; Matsuda, Kenji; Irie, Masahiro","Effect of imino nitroxyl and nitronyl nitroxyl groups on the photochromic reactivity of diarylethenes.","Organic letters","2005","7","17","3777","3780","10.1021/ol051463i","","","0.71073","MoKα","","0.0924","0.0661","","","0.1419","0.1572","","","","","","1.104","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506676","13.38","0.05","6.27","0.09","13.7","0","90","","107.3","0.5","90","","1097","17","100","","100","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","4,4,7-trimethyl-6-oxaspiro[4.5]dec-2-en-1-one","","- C13 H18 O2 -","- C12 H18 O2 -","- C48 H72 O8 -","4","1","","Prandi, Cristina; Deagostino, Annamaria; Venturello, Paolo; Occhiato, Ernesto G.","Stereoselective synthesis of spirocyclic ketones by Nazarov reaction.","Organic letters","2005","7","20","4345","4348","10.1021/ol051464a","","x-ray","0.71073","MoKα","","0.0965","0.0638","","","0.1319","0.1517","","","","","","1.072","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506677","9.4901","0.001","17.1409","0.0003","9.9187","0.0002","90","","115.528","0.001","90","","1455.95","0.16","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","cyclohexil","cyclohexil","","- C14 H23 N O4 -","- C14 H23 N O4 -","- C56 H92 N4 O16 -","4","1","","Avenoza, Alberto; Busto, Jesús H; Canal, Noelia; Peregrina, Jesús M; Pérez-Fernández, Marta","Selective Michael-aldol reaction by use of sterically hindered aluminum aryloxides as Lewis acids: an easy approach to cyclobutane amino acids.","Organic letters","2005","7","16","3597","3600","10.1021/ol0514707","","","0.71073","MoKα","","0.0504","0.0465","","","0.1241","0.1278","","","","","","1.049","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506678","7.1537","0.0002","17.2234","0.0006","9.5554","0.0003","90","","96.095","0.002","90","","1170.68","0.06","223","2","223","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","etoxi-1-acetamidometoxicarbonilciclobutano","cis-2-etoxi-1-acetamidometoxicarbonilciclobutano","","- C10 H17 N O4 -","- C10 H17 N O4 -","- C40 H68 N4 O16 -","4","1","","Avenoza, Alberto; Busto, Jesús H; Canal, Noelia; Peregrina, Jesús M; Pérez-Fernández, Marta","Selective Michael-aldol reaction by use of sterically hindered aluminum aryloxides as Lewis acids: an easy approach to cyclobutane amino acids.","Organic letters","2005","7","16","3597","3600","10.1021/ol0514707","","","0.71073","MoKα","","0.0981","0.0528","","","0.1293","0.1511","","","","","","1.038","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506679","16.4388","0.0001","20.273","0.0016","5.7205","0.0003","90","","90","","90","","1906.44","0.18","173","2","173","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","compound10","compound10","","- C20 H27 N O4 -","- C20 H27 N O4 -","- C80 H108 N4 O16 -","4","1","","Avenoza, Alberto; Busto, Jesús H; Canal, Noelia; Peregrina, Jesús M; Pérez-Fernández, Marta","Selective Michael-aldol reaction by use of sterically hindered aluminum aryloxides as Lewis acids: an easy approach to cyclobutane amino acids.","Organic letters","2005","7","16","3597","3600","10.1021/ol0514707","","","0.71073","MoKα","","0.0895","0.06","","","0.1371","0.1543","","","","","","1.05","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506680","14.9601","0.001","14.9602","0.001","12.7394","0.001","90","","90","","120","","2469.2","0.3","173","2","173","2","","","","","","","","4","P 31","P 31","144","compound11","compound11","","- C33 H55 N O4 -","- C33 H55 N O4 -","- C99 H165 N3 O12 -","3","1","","Avenoza, Alberto; Busto, Jesús H; Canal, Noelia; Peregrina, Jesús M; Pérez-Fernández, Marta","Selective Michael-aldol reaction by use of sterically hindered aluminum aryloxides as Lewis acids: an easy approach to cyclobutane amino acids.","Organic letters","2005","7","16","3597","3600","10.1021/ol0514707","","","0.71073","MoKα","","0.1616","0.1412","","","0.352","0.3694","","","","","","1.073","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1506681","33.749","0.012","12.982","0.005","19.167","0.007","90","","90","","90","","8398","5","150","","150","","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C88 H76 Cl12 N6 O6 -","- C88 H76 Cl12 N6 O6 -","- C352 H304 Cl48 N24 O24 -","4","1","","Tominaga, Masahide; Masu, Hyuma; Katagiri, Kosuke; Kato, Takako; Azumaya, Isao","Triple helicate constructed by covalent bondings: crystal structure and effective synthesis based on propeller-like substructures.","Organic letters","2005","7","17","3785","3787","10.1021/ol051477o","","","0.71073","MoKα","","0.1618","0.0892","","","0.2229","0.2679","","","","","","0.95","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506682","15.6716","0.0007","9.0731","0.0004","16.7091","0.0007","90","","113.433","0.003","90","","2179.92","0.17","160","1","160","1","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C33 H24 -","- C33 H24 -","- C132 H96 -","4","1","","Wu, Yao-Ting; Linden, Anthony; Siegel, Jay S.","Formal [(2+2)+2] and [(2+2)+(2+2)] nonconjugated dienediyne cascade cycloadditions.","Organic letters","2005","7","20","4353","4355","10.1021/ol0514799","","","0.71073","MoKα","","0.0799","0.0554","","","0.1186","0.1344","","","","","","1.049","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506683","5.198","0.0002","7.6164","0.0002","48.4186","0.0016","90","","90","","90","","1916.89","0.11","220","2","220","2","","","","","","","Synthesized by the authors. See text","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H36 O3 -","- C19 H36 O3 -","- C76 H144 O12 -","4","1","","Hanessian, Stephen; Giroux, Simon; Buffat, Maxime","Total synthesis and structural confirmation of (+)-longicin.","Organic letters","2005","7","18","3989","3992","10.1021/ol051483k","","","1.54178","CuKα","","0.1315","0.1064","","","0.2888","0.3094","","","","","","1.044","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506684","5.764","0.002","7.575","0.002","29.802","0.01","90","","90.45","0.03","90","","1301.2","0.7","293","2","293","2","","","","","","","Synthesized by the authors. See text","3","P 1 21 1","P 2yb","4","","","","- C25 H46 O5 -","- C25 H46 O5 -","- C50 H92 O10 -","2","1","","Hanessian, Stephen; Giroux, Simon; Buffat, Maxime","Total synthesis and structural confirmation of (+)-longicin.","Organic letters","2005","7","18","3989","3992","10.1021/ol051483k","","","1.54178","CuKα","","0.0794","0.0572","","","0.1518","0.1712","","","","","","0.909","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506685","10.126","0.005","14.618","0.005","18.704","0.005","90","","90","","90","","2768.6","1.8","173","2","173","2","","","","","","","","3","P c c n","-P 2ab 2ac","56","","","","- C12 H8 O4 -","- C12 H8 O4 -","- C144 H96 O48 -","12","1.5","","Gallant, Amanda J.; Yun, Michael; Sauer, Marc; Yeung, Charles S.; MacLachlan, Mark J.","Tautomerization in naphthalenediimines: a keto-enamine Schiff base macrocycle.","Organic letters","2005","7","22","4827","4830","10.1021/ol051511z","","","0.71073","MoKα","","0.1243","0.0435","","","0.0981","0.1075","","","","","","0.683","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506686","11.649","0.005","7.4767","0.0016","23.829","0.008","90","","103.823","0.013","90","","2015.3","1.2","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H22 N2 O4 -","- C26 H22 N2 O4 -","- C104 H88 N8 O16 -","4","1","","Gallant, Amanda J.; Yun, Michael; Sauer, Marc; Yeung, Charles S.; MacLachlan, Mark J.","Tautomerization in naphthalenediimines: a keto-enamine Schiff base macrocycle.","Organic letters","2005","7","22","4827","4830","10.1021/ol051511z","","","0.71073","MoKα","","0.0765","0.0385","","","0.0857","0.0995","","","","","","0.99","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506687","11.067","","11.991","","14.815","","101.06","","93.76","","95.58","","1913.2","","173","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H48 N4 O8 -","- C38 H48 N4 O8 -","- C76 H96 N8 O16 -","2","1","","Gallant, Amanda J.; Yun, Michael; Sauer, Marc; Yeung, Charles S.; MacLachlan, Mark J.","Tautomerization in naphthalenediimines: a keto-enamine Schiff base macrocycle.","Organic letters","2005","7","22","4827","4830","10.1021/ol051511z","","","0.71073","MoKα","","0.201","0.0596","","","0.0996","0.1372","","","","","","0.957","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506688","22.652","0.008","10.982","0.004","18.713","0.004","90","","95.607","0.011","90","","4633","3","296.1","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C29 H24 O1.5 P -","- C29 H24 O1.5 P -","- C232 H192 O12 P8 -","8","1","","Onodera, Gen; Matsumoto, Hideyuki; Milton, Marilyn Daisy; Nishibayashi, Yoshiaki; Uemura, Sakae","Ruthenium-catalyzed formation of aryl(diphenyl)phosphine oxides by reactions of propargylic alcohols with diphenylphosphine oxide.","Organic letters","2005","7","18","4029","4032","10.1021/ol0515311","","","0.71069","MoKα","","","0.0466","","","","0.0581","","","","","","7.312","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506689","8.583","0.004","18.449","0.008","15.254","0.007","90","0.0017","95.9348","0.0018","90","0.0017","2402.5","1.9","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H30 B P -","- C30 H30 B P -","- C120 H120 B4 P4 -","4","1","","Agou, Tomohiro; Kobayashi, Junji; Kawashima, Takayuki","Dibenzophosphaborin: a hetero-pi-conjugated molecule with fluorescent properties based on intramolecular charge transfer between phosphorus and boron atoms.","Organic letters","2005","7","20","4373","4376","10.1021/ol051537q","","","0.7107","MoKα","","0.0632","0.0565","","","0.1389","0.1447","","","","","","1.051","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506690","8.138","0.004","16.833","0.009","16.975","0.009","90","","92.835","0.003","90","","2323","2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H27 B P -","- C30 H27 B P -","- C120 H108 B4 P4 -","4","1","","Agou, Tomohiro; Kobayashi, Junji; Kawashima, Takayuki","Dibenzophosphaborin: a hetero-pi-conjugated molecule with fluorescent properties based on intramolecular charge transfer between phosphorus and boron atoms.","Organic letters","2005","7","20","4373","4376","10.1021/ol051537q","","","0.7107","MoKα","","0.0623","0.0445","","","0.0796","0.0871","","","","","","0.942","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506691","10.47","0.002","17.247","0.004","17.307","0.004","90","","90","","90","","3125.2","1.2","193","2","193","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C35 H48 Br N O4 -","- C35 H48 Br N O4 -","- C140 H192 Br4 N4 O16 -","4","1","","Johannes, Jeffrey W.; Wenglowsky, Steve; Kishi, Yoshito","Biomimetic macrocycle-forming Diels-Alder reaction of an iminium dienophile: synthetic studies directed toward gymnodimine.","Organic letters","2005","7","18","3997","4000","10.1021/ol051553n","","","0.71073","MoKα","","0.0546","0.039","","","0.0724","0.0775","","","","","","0.997","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506692","5.9697","0.0005","13.3048","0.0012","22.401","0.002","90","","90","","90","","1779.2","0.3","273","2","273","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","hexahydro-1-benzofuran-3(2H)-one","","","- C9 H14 O3 -","- C9 H14 O3 -","- C72 H112 O24 -","8","1","","Muthusamy, Sengodagounder; Gnanaprakasam, Boopathy; Suresh, Eringathodi","Regioselective nucleophilic addition to carbonyl ylide intermediates: a novel diastereoselective synthesis of cycloalkyl fused furan-3-ones.","Organic letters","2005","7","21","4577","4580","10.1021/ol051562w","","","0.71073","MoKα","","0.0608","0.0522","","","0.1358","0.1431","","","","","","1.07","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506693","12.4574","0.0018","7.9073","0.0011","14.806","0.002","90","","109.547","0.003","90","","1374.4","0.3","273","2","273","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","tetrahydro-2H-cyclopenta[b]furan-3(3aH)-one","","","- C14 H16 N2 O4 -","- C14 H16 N2 O4 -","- C56 H64 N8 O16 -","4","1","","Muthusamy, Sengodagounder; Gnanaprakasam, Boopathy; Suresh, Eringathodi","Regioselective nucleophilic addition to carbonyl ylide intermediates: a novel diastereoselective synthesis of cycloalkyl fused furan-3-ones.","Organic letters","2005","7","21","4577","4580","10.1021/ol051562w","","","0.71073","MoKα","","0.0923","0.0676","","","0.187","0.2265","","","","","","1.13","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506694","6.6119","0.0009","10.4176","0.0014","13.0721","0.0017","91.049","0.003","95.024","0.003","95.584","0.003","892.4","0.2","300","2","273","2","","","","","","","","4","P -1","-P 1","2","3-oxooctahydro-1-benzofuran-2-carboxylate","","","- C18 H22 N2 O6 -","- C18 H22 N2 O6 -","- C36 H44 N4 O12 -","2","1","","Muthusamy, Sengodagounder; Gnanaprakasam, Boopathy; Suresh, Eringathodi","Regioselective nucleophilic addition to carbonyl ylide intermediates: a novel diastereoselective synthesis of cycloalkyl fused furan-3-ones.","Organic letters","2005","7","21","4577","4580","10.1021/ol051562w","","","0.71073","MoKα","","0.155","0.0778","","","0.1642","0.2211","","","","","","1.03","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506695","10.605","0.002","15","0.003","21.184","0.004","90","","90","","90","","3369.8","1.1","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","(3aS,5R,6S,6aS)-5-(tert-butyldimethylsilyloxy)-6- (trityloxymethyl)-1,3a,4,5,6,6a-hexahydropentalen- 2-yl trifluoromethanesulfonate","","- C35 H41 F3 O5 S Si -","- C35 H41 F3 O5 S Si -","- C140 H164 F12 O20 S4 Si4 -","4","1","","Sheddan, Neil A.; Mulzer, Johann","Access to isocarbacyclin derivatives via substrate-controlled enolate formation: total synthesis of 15-deoxy-16-(m-tolyl)- 17,18,19,20-tetranorisocarbacyclin","Organic letters","2005","7","23","5115","5118","10.1021/ol0515762","","","0.71073","MoKα","","0.0499","0.04","","","0.0987","0.1051","","","","","","1.058","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506696","11.1184","0.0002","14.1118","0.0002","9.5312","0.0002","90","","95.192","0.001","90","","1489.32","0.05","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H16 N2 O3 S -","- C15 H16 N2 O3 S -","- C60 H64 N8 O12 S4 -","4","1","","García Ruano, José Luis; Topp, Markus; López-Cantarero, Jesús; Alemán, José; Remuiñán, Modesto J; Cid, M Belén","Asymmetric aza-Henry reactions from N-p-tolylsulfinylimines.","Organic letters","2005","7","20","4407","4410","10.1021/ol051580d","","","1.54178","CuKα","","0.0407","0.0365","","","0.097","0.1004","","","","","","1.045","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506697","13.413","0.001","8.473","0.001","22.024","0.001","90","","106.357","0.001","90","","2401.7","0.4","150","0.1","150","0.1","","","","","","","","8","P 1 21/c 1","-P 2ybc","14","","","","- C20 H15 Au F6 N O4 P S2 -","- C20 H15 Au F6 N O4 P S2 -","- C80 H60 Au4 F24 N4 O16 P4 S8 -","4","1","","Mézailles, Nicolas; Ricard, Louis; Gagosz, Fabien","Phosphine gold(I) bis-(trifluoromethanesulfonyl)imidate complexes as new highly efficient and air-stable catalysts for the cycloisomerization of enynes.","Organic letters","2005","7","19","4133","4136","10.1021/ol0515917","","","0.71069","MoKα","","0.0354","0.0278","","","0.0707","0.0742","","","","","","1.028","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506698","9.0996","0.0007","11.5389","0.0008","25.785","0.002","90","","90","","90","","2707.4","0.4","150","","150","","","","","","","","P. Joensuu","3","P b c a","-P 2ac 2ab","61","","","","- C15 H20 O3 -","- C15 H20 O3 -","- C120 H160 O24 -","8","1","","Lam, Hon Wai; Joensuu, Pekka M.","Cu(I)-catalyzed reductive aldol cyclizations: diastereo- and enantioselective synthesis of beta-hydroxylactones.","Organic letters","2005","7","19","4225","4228","10.1021/ol051649h","","","0.71073","MoKα","","0.1124","0.0554","","0.1168","0.1026","0.1168","","","","","","0.7612","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506699","8.3224","0.0004","10.8314","0.0005","10.9546","0.0005","92.665","0.003","106.145","0.003","92.45","0.003","945.92","0.08","150","","150","","","","","","","","P. Joensuu","3","P -1","-P 1","2","","","","- C9 H16 O3 -","- C9 H16 O3 -","- C36 H64 O12 -","4","2","","Lam, Hon Wai; Joensuu, Pekka M.","Cu(I)-catalyzed reductive aldol cyclizations: diastereo- and enantioselective synthesis of beta-hydroxylactones.","Organic letters","2005","7","19","4225","4228","10.1021/ol051649h","","","0.71073","MoKα","","0.0563","0.0414","","0.1074","0.1037","0.1074","","","","","","0.8351","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506700","7.418","0.0002","9.0469","0.0003","18.673","0.0006","90","","90","","90","","1253.14","0.07","150","2","150","2","","","","","","","Hon Lam, reaction PJC16A","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 Cl O3 -","- C13 H15 Cl O3 -","- C52 H60 Cl4 O12 -","4","1","","Lam, Hon Wai; Joensuu, Pekka M.","Cu(I)-catalyzed reductive aldol cyclizations: diastereo- and enantioselective synthesis of beta-hydroxylactones.","Organic letters","2005","7","19","4225","4228","10.1021/ol051649h","","","0.71073","MoKα","","0.0432","0.0361","","","0.0918","0.0944","","","","","","1.078","","","","has coordinates,has disorder","211332","2020-10-21","18:00:00",""
"1506701","6.604","0.001","15.346","0.002","19.811","0.003","90","","90","","90","","2007.7","0.5","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C22 H26 O S2 -","- C22 H26 O S2 -","- C88 H104 O4 S8 -","4","1","","Xie, Xingang; Yue, Guoren; Tang, Shouchu; Huo, Xing; Liang, Qiren; She, Xuegong; Pan, Xinfu","Highly diastereoselective formation of 1,2,3-trisubstituted cyclopropane derivatives.","Organic letters","2005","7","18","4057","4059","10.1021/ol051653t","","","0.71073","MoKα","","0.053","0.0374","","","0.0756","0.0788","","","","","","0.885","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506702","8.4794","0.0003","6.8463","0.0003","10.1247","0.0005","90","","103.613","0.004","90","","571.25","0.04","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C11 H12 O2 S2 -","- C11 H12 O2 S2 -","- C22 H24 O4 S4 -","2","1","","Wedel, Tobias; Podlech, Joachim","Enolate addition to a 2-alkylidene[1,3]dithiane-derived bissulfoxide. A new a(2)-acceptor.","Organic letters","2005","7","18","4013","4015","10.1021/ol051670i","","","1.54178","CuKα","","0.0469","0.0447","","","0.1167","0.1221","","","","","","1.05","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506703","10.0518","0.0006","10.0518","0.0006","16.5499","0.0008","90","","90","","90","","1672.18","0.16","293","2","293","2","","","","","","","","4","P 43","P 4cw","78","","","","- C17 H22 O3 S2 -","- C17 H22 O3 S2 -","- C68 H88 O12 S8 -","4","1","","Wedel, Tobias; Podlech, Joachim","Enolate addition to a 2-alkylidene[1,3]dithiane-derived bissulfoxide. A new a(2)-acceptor.","Organic letters","2005","7","18","4013","4015","10.1021/ol051670i","","","1.54178","CuKα","","0.0522","0.0508","","","0.1361","0.1392","","","","","","1.022","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506704","18.3881","0.0004","9.819","0.0003","22.354","0.0006","90","","110.52","0.001","90","","3779.99","0.18","200","2","200","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C15 H28 I N O4 -","- C15 H28 I N O4 -","- C120 H224 I8 N8 O32 -","8","2","","Sheldrake, Helen M.; Wallace, Timothy W.; Wilson, Craig P.","Functionalized cyclobutenes via multicomponent thermal [2 + 2] cycloaddition reactions.","Organic letters","2005","7","19","4233","4236","10.1021/ol051675f","","x-ray","0.71073","MoKα","","0.0651","0.0425","","","0.0836","0.0945","","","","","","1.109","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506705","10.7031","0.0017","7.6834","0.0011","14.286","0.002","90","","96.923","0.001","90","","1166.3","0.3","143","1","143","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H33 I O6 -","- C21 H33 I O6 -","- C42 H66 I2 O12 -","2","1","","Smith, 3rd, Amos B; Xian, Ming; Liu, Fenghua","Design, total synthesis, and evaluation of C13-C14 cyclopropane analogues of (+)-discodermolide.","Organic letters","2005","7","21","4613","4616","10.1021/ol051691c","","","0.71069","MoKα","","0.0282","0.0266","","","0.0633","0.0646","","","","","","1.07","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506706","28.31","0.011","6.229","0.002","10.339","0.004","90","","100.58","0.007","90","","1792.2","1.1","163","2","163","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H34 O3 -","- C18 H34 O2.99 -","- C72 H136 O11.96 -","4","1","","Ramirez, Armando; Woerpel, K. A.","Synthesis of 1,2-dioxolanes by annulation reactions of peroxycarbenium ions with alkenes.","Organic letters","2005","7","21","4617","4620","10.1021/ol051703u","","","0.71073","MoKα","","0.1155","0.0666","","","0.1615","0.1891","","","","","","1.049","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1506707","20.395","0.002","11.2144","0.0013","13.2709","0.0016","90","","90","","90","","3035.3","0.6","273","2","273","2","","","","","","","","5","P b c n","-P 2n 2ab","60","15","7,14,22,29-tetraaza-1,5,16,20-tetrachloro-31,31,32,32-tetramethoxynonacyclo [18.10.1.15,16.02,19.04,17.06,15.08,13.021,30.023,28] dotriacontane-6(15),8,9,11,14,21(30),23,24,26,28,29-decaene.","","- C32 H28 Cl4 N4 O4 -","- C32 H28 Cl4 N4 O4 -","- C128 H112 Cl16 N16 O16 -","4","0.5","","Chou, Teh-Chang; Liao, Kung-Ching; Lin, Jin-Ju","Synthesis and luminescence properties of U-shaped polycyclic molecules containing syn-facial functionalized quinoxaline rings.","Organic letters","2005","7","22","4843","4846","10.1021/ol051707z","","","0.71073","MoKα","","0.0509","0.037","","","0.0874","0.0924","","","","","","0.983","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506708","11.2393","0.0006","16.951","0.0009","17.1697","0.0009","90","","101.104","0.001","90","","3209.9","0.3","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","16","8,15,24,31-tetraaza-1,6,17,22-tetrachloro-33,33,34,34-tetramethoxynonacyclo [20.10.1.116,17.02,21.05,18.07,16.09,14.023,32.025,30] tetratricontane-7(16),9,10,12,15,23(32),25,26,28,31-decaene.","","- C34 H32 Cl4 N4 O4 -","- C34 H32 Cl4 N4 O4 -","- C136 H128 Cl16 N16 O16 -","4","1","","Chou, Teh-Chang; Liao, Kung-Ching; Lin, Jin-Ju","Synthesis and luminescence properties of U-shaped polycyclic molecules containing syn-facial functionalized quinoxaline rings.","Organic letters","2005","7","22","4843","4846","10.1021/ol051707z","","","0.71073","MoKα","","0.0353","0.0316","","","0.0846","0.0876","","","","","","1.038","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506709","9.8631","0.001","20.512","0.002","13.5322","0.0014","90","","107.616","0.002","90","","2609.3","0.5","273","2","273","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C28 H22 O10 -","- C28 H22 O10 -","- C112 H88 O40 -","4","1","","Nair, Vijay; Pillai, Abhilash N.; Beneesh, P. B.; Suresh, Eringathodi","Engaging the pyridine-DMAD zwitterion in a novel strategy for the selective synthesis of highly substituted benzene and cyclopentenedione derivatives.","Organic letters","2005","7","21","4625","4628","10.1021/ol051723w","","","0.71073","MoKα","","0.0606","0.0511","","","0.1477","0.156","","","","","","1.037","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506710","13.581","0.0017","14.205","0.001","14.361","0.0018","90","","98.096","0.011","90","","2742.9","0.5","250","2","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H37 N O8 S Si -","- C23 H37 N O8 S Si -","- C92 H148 N4 O32 S4 Si4 -","4","1","","Boglio, Cécile; Stahlke, Sebastian; Thorimbert, Serge; Malacria, Max","A stereoselective route toward polyhydoxylated piperidines. A total synthesis of (+/-)-deoxymannojirimycin.","Organic letters","2005","7","22","4851","4854","10.1021/ol051745i","","x-ray","0.71073","MoKα","","","0.0506","","","","0.1447","","","","","","1.057","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506711","17.1855","0.0011","8.6653","0.0006","24.9779","0.0016","90","","90","","90","","3719.6","0.4","173","2","173","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C16 H15 F6 N O4 S -","- C16 H15 F6 N O4 S -","- C128 H120 F48 N8 O32 S8 -","8","1","","Loeb, Stephen J.; Tiburcio, Jorge; Vella, Sarah J.","[2]pseudorotaxane formation with N-benzylanilinium axles and 24-crown-8 ether wheels.","Organic letters","2005","7","22","4923","4926","10.1021/ol051786e","","","0.71073","MoKα","","0.1007","0.0885","","","0.1656","0.1718","","","","","","1.149","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506712","13.4607","0.0009","14.0815","0.0009","16.0914","0.0011","81.541","0.001","77.187","0.001","66.644","0.001","2724.4","0.3","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C52 H60 F9 N O15 S -","- C52 H60 F9 N O15 S -","- C104 H120 F18 N2 O30 S2 -","2","1","","Loeb, Stephen J.; Tiburcio, Jorge; Vella, Sarah J.","[2]pseudorotaxane formation with N-benzylanilinium axles and 24-crown-8 ether wheels.","Organic letters","2005","7","22","4923","4926","10.1021/ol051786e","","","0.71073","MoKα","","0.1292","0.0895","","","0.2523","0.2848","","","","","","1.035","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506713","9.8489","0.0005","10.864","0.0006","21.406","0.0012","89.398","0.001","78.804","0.001","63.063","0.001","1995.18","0.19","173","2","173","2","","","","","","","","6","P -1","-P 1","2","","","","- C40 H50 F3 N O13 S -","- C40 H50 F3 N O13 S -","- C80 H100 F6 N2 O26 S2 -","2","1","","Loeb, Stephen J.; Tiburcio, Jorge; Vella, Sarah J.","[2]pseudorotaxane formation with N-benzylanilinium axles and 24-crown-8 ether wheels.","Organic letters","2005","7","22","4923","4926","10.1021/ol051786e","","","0.71073","MoKα","","0.038","0.0363","","","0.1074","0.1092","","","","","","0.936","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506714","6.1206","0.0005","12.592","0.001","14.007","0.001","90","","90","","90","","1079.53","0.15","290","2","290","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H13 N O2 -","- C12 H13 N O2 -","- C48 H52 N4 O8 -","4","1","","Dong, Lin; Xu, Yan-Jun; Cun, Lin-Feng; Cui, Xin; Mi, Ai-Qiao; Jiang, Yao-Zhong; Gong, Liu-Zhu","Asymmetric nitroallylation of arylboronic acids with nitroallyl acetates catalyzed by chiral rhodium complexes and its application in a concise total synthesis of optically pure (+)-gamma-lycorane.","Organic letters","2005","7","19","4285","4288","10.1021/ol051795n","","","0.71073","MoKα","","0.0543","0.0327","","","0.0652","0.07","","","","","","0.961","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506715","14.549","0.002","11.0148","0.0015","12.6709","0.0017","90","","92","0.011","90","","2029.3","0.5","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C21 H25 N O4 S -","- C21 H25 N O4 S -","- C84 H100 N4 O16 S4 -","4","1","","Yu, Chan-Mo; Youn, Jinsuop; Yoon, Seok-Keun; Hong, Young-Tack","A highly stereoselective sequential allylic transfer reaction of diene with diboronyl reagent and aldehydes promoted by nickel catalyst.","Organic letters","2005","7","20","4507","4510","10.1021/ol051806c","","","0.71073","MoKα","","0.134","0.0594","","","0.1174","0.1522","","","","","","1.014","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506716","8.79","0.002","12.6073","0.0016","21.886","0.005","90","","96.035","0.018","90","","2411.9","0.8","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H27 Cl2 N O4 S -","- C22 H27 Cl2 N O4 S -","- C88 H108 Cl8 N4 O16 S4 -","4","1","","Yu, Chan-Mo; Youn, Jinsuop; Yoon, Seok-Keun; Hong, Young-Tack","A highly stereoselective sequential allylic transfer reaction of diene with diboronyl reagent and aldehydes promoted by nickel catalyst.","Organic letters","2005","7","20","4507","4510","10.1021/ol051806c","","","0.71073","MoKα","","0.1704","0.0906","","","0.2367","0.315","","","","","","1.062","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506717","6.108","0.004","27.256","0.012","12.829","0.005","90","","93.49","0.04","90","","2131.8","1.9","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H27 N O4 S -","- C22 H27 N O4 S -","- C88 H108 N4 O16 S4 -","4","1","","Yu, Chan-Mo; Youn, Jinsuop; Yoon, Seok-Keun; Hong, Young-Tack","A highly stereoselective sequential allylic transfer reaction of diene with diboronyl reagent and aldehydes promoted by nickel catalyst.","Organic letters","2005","7","20","4507","4510","10.1021/ol051806c","","","0.71073","MoKα","","0.0885","0.047","","","0.0914","0.1072","","","","","","1.042","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506718","12.9029","0.0017","14.6931","0.0019","19.457","0.003","90","","107.321","0.002","90","","3521.5","0.8","110","2","110","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C36 H38 N4 O4 -","- C34.5 H51 N4 O7.5 -","- C138 H204 N16 O30 -","4","2","","Amorín, Manuel; Brea, Roberto J.; Castedo, Luis; Granja, Juan R.","The smallest alpha,gamma-peptide nanotubulet segments: cyclic alpha,gamma-tetrapeptide dimers.","Organic letters","2005","7","21","4681","4684","10.1021/ol0518885","","x-ray","0.71073","MoKα","","0.097","0.0631","","","0.1652","0.1899","","","","","","1.029","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506719","11.611","0.002","10.747","0.002","20.951","0.002","90","","94.44","0.01","90","","2606.5","0.7","203","2","203","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H24 O2 -","- C15 H24 O2 -","- C120 H192 O16 -","8","2","","Tilly, David P.; Williams, Craig M.; Bernhardt, Paul V.","Construction of the cyclovibsanin core via a biogenetically modeled approach.","Organic letters","2005","7","23","5155","5157","10.1021/ol051897d","","x-ray","0.71073","MoKα","","0.1787","0.0538","","","0.1198","0.1636","","","","","","0.968","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506720","16.5687","0.0013","5.235","0.0004","16.4498","0.0013","90","","92.787","0.001","90","","1425.12","0.19","292","2","292","2","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C13 H14 Br N O4 -","- C13 H14 Br N O4 -","- C52 H56 Br4 N4 O16 -","4","1","","Wang, Jian; Li, Hao; Duan, Wenhu; Zu, Liansuo; Wang, Wei","Organocatalytic asymmetric Michael addition of 2,4-pentandione to nitroolefins.","Organic letters","2005","7","21","4713","4716","10.1021/ol0519137","","","0.71073","MoKα","","0.0546","0.0354","","","0.0818","0.0944","","","","","","1.026","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506721","7.055","0.0001","18.676","0.0005","9.813","0.0002","90","","108.071","0.0013","90","","1229.18","0.05","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H14 N2 O4 -","- C13 H14 N2 O4 -","- C52 H56 N8 O16 -","4","1","","Blakemore, Paul R.; Kilner, Colin; Norcross, Neil R.; Astles, Peter C.","A practical synthesis of (+/-)-alpha-isosparteine from a tetraoxobispidine core.","Organic letters","2005","7","21","4721","4724","10.1021/ol0519184","","x-ray","0.71073","MoKα","","0.0631","0.0434","","","0.1113","0.1243","","","","","","1.039","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506722","8.5596","0.0008","11.4819","0.0012","26.25","0.003","90","","90","","90","","2579.9","0.5","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C15 H18 N2 O4 -","- C15 H18 N2 O4 -","- C120 H144 N16 O32 -","8","1","","Blakemore, Paul R.; Kilner, Colin; Norcross, Neil R.; Astles, Peter C.","A practical synthesis of (+/-)-alpha-isosparteine from a tetraoxobispidine core.","Organic letters","2005","7","21","4721","4724","10.1021/ol0519184","","","0.71073","MoKα","","0.0487","0.0336","","","0.0807","0.0869","","","","","","1.055","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506723","13.9423","0.0018","10.7041","0.0014","17.044","0.002","90","","91.314","0.002","90","","2543","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H13 Br O3 -","- C13 H13 Br O3 -","- C104 H104 Br8 O24 -","8","2","","Zhao, Gui-Ling; Shi, Yong-Ling; Shi, Min","Synthesis of functionalized 2H-1-benzopyrans by DBU-catalyzed reactions of salicylic aldehydes with allenic ketones and esters.","Organic letters","2005","7","20","4527","4530","10.1021/ol051920v","","","0.71073","MoKα","","0.1027","0.0387","","","0.074","0.0827","","","","","","0.739","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506724","8.8902","0.0009","9.774","0.001","15.87","0.002","74.891","0.003","89.892","0.002","89.964","0.006","1331.3","0.3","296.1","","","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H30 Cu2 I2 N2 Si2 -","- C20 H30 Cu2 I2 N2 Si2 -","- C40 H60 Cu4 I4 N4 Si4 -","2","1","","Kamei, Toshiyuki; Fujita, Kazuyoshi; Itami, Kenichiro; Yoshida, Jun-ichi","Copper-catalyzed allylation of carbonyl derivatives using allyl(2-pyridyl)silanes.","Organic letters","2005","7","21","4725","4728","10.1021/ol051925s","","","0.7107","MoKα","","","0.066","","","","0.1","","","","","","2.844","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506725","36.529","0.003","11.7506","0.0009","26.095","0.002","90","","133.184","0.002","90","","8167.3","1.1","150","2","150","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C23 H24 O2 Sn -","- C23 H23.5 O2 Sn -","- C368 H376 O32 Sn16 -","16","4","","Dimopoulos, Paschalis; George, Jonathan; Tocher, Derek A.; Manaviazar, Soraya; Hale, Karl J.","Mechanistic studies on the O-directed free-radical hydrostannation of disubstituted acetylenes with Ph3SnH and Et3B and on the iodination of allylically oxygenated alpha-triphenylstannylalkenes.","Organic letters","2005","7","24","5377","5380","10.1021/ol051937d","","","0.71073","MoKα","","0.0317","0.0309","","","0.0735","0.0741","","","","","","1.093","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506726","8.1399","0.0004","15.1636","0.0008","17.2457","0.0009","108.047","0.001","98.828","0.001","91.063","0.001","1994.99","0.18","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C23 H24 O Sn -","- C23 H24 O Sn -","- C92 H96 O4 Sn4 -","4","2","","Dimopoulos, Paschalis; George, Jonathan; Tocher, Derek A.; Manaviazar, Soraya; Hale, Karl J.","Mechanistic studies on the O-directed free-radical hydrostannation of disubstituted acetylenes with Ph3SnH and Et3B and on the iodination of allylically oxygenated alpha-triphenylstannylalkenes.","Organic letters","2005","7","24","5377","5380","10.1021/ol051937d","","","0.71073","MoKα","","0.0357","0.0323","","","0.0765","0.0786","","","","","","1.025","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506727","7.418","0.0007","15.6288","0.0015","32.908","0.003","90","","95.08","0.002","90","","3800.2","0.6","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 O Sn -","- C22 H22 O Sn -","- C176 H176 O8 Sn8 -","8","2","","Dimopoulos, Paschalis; George, Jonathan; Tocher, Derek A.; Manaviazar, Soraya; Hale, Karl J.","Mechanistic studies on the O-directed free-radical hydrostannation of disubstituted acetylenes with Ph3SnH and Et3B and on the iodination of allylically oxygenated alpha-triphenylstannylalkenes.","Organic letters","2005","7","24","5377","5380","10.1021/ol051937d","","","0.71073","MoKα","","0.0588","0.0547","","","0.1333","0.1365","","","","","","1.064","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506728","15.4757","0.0009","40.118","0.002","7.287","0.0004","90","","90","","90","","4524.2","0.4","150","2","150","2","","","","","","","","4","P c c n","-P 2ab 2ac","56","","","","- C27 H28 O Sn -","- C27 H28 O Sn -","- C216 H224 O8 Sn8 -","8","1","","Dimopoulos, Paschalis; George, Jonathan; Tocher, Derek A.; Manaviazar, Soraya; Hale, Karl J.","Mechanistic studies on the O-directed free-radical hydrostannation of disubstituted acetylenes with Ph3SnH and Et3B and on the iodination of allylically oxygenated alpha-triphenylstannylalkenes.","Organic letters","2005","7","24","5377","5380","10.1021/ol051937d","","","0.71073","MoKα","","0.0548","0.0505","","","0.1135","0.1158","","","","","","1.108","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506729","19.425","0.002","13.9918","0.0015","11.2789","0.0012","90","","91.547","0.002","90","","3064.4","0.6","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C36 H34 O2 Sn -","- C36 H34 O2 Sn -","- C144 H136 O8 Sn4 -","4","1","","Dimopoulos, Paschalis; George, Jonathan; Tocher, Derek A.; Manaviazar, Soraya; Hale, Karl J.","Mechanistic studies on the O-directed free-radical hydrostannation of disubstituted acetylenes with Ph3SnH and Et3B and on the iodination of allylically oxygenated alpha-triphenylstannylalkenes.","Organic letters","2005","7","24","5377","5380","10.1021/ol051937d","","","0.71073","MoKα","","0.0452","0.0334","","","0.0813","0.0883","","","","","","0.985","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506730","10.494","0.0016","9.1968","0.0014","26.727","0.004","90","","98.934","0.003","90","","2548.2","0.7","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C23 H38 N2 O6 -","- C23 H38 N2 O6 -","- C92 H152 N8 O24 -","4","1","","Nair, Vijay; Biju, A. T.; Vinod, A. U.; Suresh, Eringathodi","Reaction of Huisgen zwitterion with 1,2-benzoquinones and isatins: expeditious synthesis of dihydro-1,2,3-benzoxadiazoles and spirooxadiazolines.","Organic letters","2005","7","23","5139","5142","10.1021/ol051956n","","","0.71073","MoKα","","0.1132","0.0811","","","0.1833","0.1986","","","","","","1.104","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506731","8.2282","0.0009","10.8106","0.0012","12.1252","0.0014","89.631","0.002","79.62","0.002","70.082","0.002","995.68","0.19","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C21 H21 N3 O5 -","- C21 H21 N3 O5 -","- C42 H42 N6 O10 -","2","1","","Nair, Vijay; Biju, A. T.; Vinod, A. U.; Suresh, Eringathodi","Reaction of Huisgen zwitterion with 1,2-benzoquinones and isatins: expeditious synthesis of dihydro-1,2,3-benzoxadiazoles and spirooxadiazolines.","Organic letters","2005","7","23","5139","5142","10.1021/ol051956n","","","0.71073","MoKα","","0.0876","0.0619","","","0.1664","0.1914","","","","","","1.052","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506732","9.0402","0.0002","9.0402","0.0002","29.7809","0.001","90","","90","","90","","2433.85","0.11","298","","298","","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","Bbc-Phg-OMe","","","- C24 H24 N2 O8 -","- C24 H24 N2 O8 -","- C96 H96 N8 O32 -","4","0.5","","Ramesh, R.; Chandrasekaran, S.","But-2-ynylbisoxycarbonyl chloride: a novel C2-symmetric reagent for the protection of amines and amino acids.","Organic letters","2005","7","22","4947","4950","10.1021/ol051960z","","","0.71073","MoKα","","0.0638","0.0608","","","0.1285","0.13","","","","","","1.272","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506733","8.4","0.006","16.96","0.01","22.39","0.01","90","","90","","90","","3190","3","98.1","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H42 Bi Br3 N2 O6 -","- C24 H37 Bi Br3 N2 O6 -","- C96 H148 Bi4 Br12 N8 O24 -","4","1","","Kobayashi, Shü; Ogino, Tsuyoshi; Shimizu, Haruka; Ishikawa, Shunpei; Hamada, Tomoaki; Manabe, Kei","Bismuth triflate-chiral bipyridine complexes as water-compatible chiral Lewis acids.","Organic letters","2005","7","21","4729","4731","10.1021/ol051965w","","","0.7107","MoKα","","","0.051","","","","0.132","","","","","","1.007","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506734","12.791","0.005","11.2002","0.0017","14.029","0.004","90","","112.75","0.02","90","","1853.5","1","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C41 H50 O3 S2 Si -","- C41 H50 O3 S2 Si -","- C82 H100 O6 S4 Si2 -","2","1","","Leung, Leo M. H.; Boydell, A. James; Gibson, Vicky; Light, Mark E.; Linclau, Bruno","A stereoselective cyclization to carbafuranose derivatives starting from 1,4-bis-epoxides.","Organic letters","2005","7","23","5183","5186","10.1021/ol052009h","","","0.71073","MoKα","","0.1453","0.0663","","","0.1067","0.1293","","","","","","0.997","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506735","7.0222","0.0004","12.2044","0.0006","10.4549","0.0006","90","","95.631","0.001","90","","891.68","0.08","213","2","213","2","","","","","","","","3","P 1 21 1","P 2yb","4","MPPIM-B","MPPIM-B","","- C10 H12 O4 -","- C10 H12 O4 -","- C40 H48 O16 -","4","2","","Doyle, Michael P.; Wang, Yuanhua; Ghorbani, Pejman; Bappert, Erhard","Amplification of asymmetric induction in sequential reactions of bis-diazoacetates catalyzed by chiral dirhodium(II) carboxamidates.","Organic letters","2005","7","22","5035","5038","10.1021/ol0520121","","","0.71073","MoKα","","0.0294","0.0277","","","0.0582","0.0594","","","","","","1","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506736","5.3861","0.0003","10.9679","0.0007","8.4107","0.0005","90","","107.867","0.001","90","","472.89","0.05","213","2","213","2","","","","","","","","3","P 1 21 1","P 2yb","4","MPPIM-A","MPPIM-A","","- C10 H12 O4 -","- C10 H12 O4 -","- C20 H24 O8 -","2","1","","Doyle, Michael P.; Wang, Yuanhua; Ghorbani, Pejman; Bappert, Erhard","Amplification of asymmetric induction in sequential reactions of bis-diazoacetates catalyzed by chiral dirhodium(II) carboxamidates.","Organic letters","2005","7","22","5035","5038","10.1021/ol0520121","","","0.71073","MoKα","","0.041","0.0354","","","0.0738","0.0782","","","","","","1","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506737","8.4475","0.0008","5.4646","0.0005","10.2032","0.0009","90","","99.118","0.002","90","","465.05","0.07","213","2","213","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","S-001-A","S-001-A","","- C10 H12 O4 -","- C10 H12 O4 -","- C20 H24 O8 -","2","0.5","","Doyle, Michael P.; Wang, Yuanhua; Ghorbani, Pejman; Bappert, Erhard","Amplification of asymmetric induction in sequential reactions of bis-diazoacetates catalyzed by chiral dirhodium(II) carboxamidates.","Organic letters","2005","7","22","5035","5038","10.1021/ol0520121","","","0.71073","MoKα","","0.0394","0.0354","","","0.0745","0.0776","","","","","","1","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506738","10.3478","0.0005","9.7922","0.0005","18.2446","0.0012","90","","90","","90","","1848.68","0.18","148","","148","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Compound: 1-[(4R)-3-((2S)-1-methylpyrrolidin-2-yl)-4-phenyl- (1,4-dihydropyridyl)]-2,2-dimethylpropan-1-one","","- C21 H28 N2 O -","- C21 H28 N2 O -","- C84 H112 N8 O4 -","4","1","","Comins, Daniel L.; King, Laura S.; Smith, Emilie D.; Février, Florence C","Synthesis of C-4 substituted nicotine derivatives via an N-acylpyridinium salt of (S)-nicotine.","Organic letters","2005","7","22","5059","5062","10.1021/ol0520469","","","0.71073","MolybdenumKα","","0.029","0.029","","0.033","0.033","","","","","1.26","1.26","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506739","10.3948","0.0002","13.8919","0.0002","25.1936","0.0003","90.6016","0.0004","91.8742","0.0004","97.9594","0.0005","3600.65","0.1","150","","150","","","","","","The material was crystallised at ambient temperature. A suitable crystal was cooled rapidly to 150K for single-crystal X-ray diffraction analysis.","","synthesis as described","6","P -1","-P 1","2","","","","- C154 H175 Cl3 N10 O3 Zn2 -","- C154 H175 Cl3 N10 O3 Zn2 -","- C154 H175 Cl3 N10 O3 Zn2 -","1","0.5","","Frampton, Michael J.; Akdas, Huriye; Cowley, Andrew R.; Rogers, Joy E.; Slagle, Jonathan E.; Fleitz, Paul A.; Drobizhev, Mikhail; Rebane, Aleksander; Anderson, Harry L.","Synthesis, crystal structure, and nonlinear optical behavior of beta-unsubstituted meso-meso E-vinylene-linked porphyrin dimers.","Organic letters","2005","7","24","5365","5368","10.1021/ol0520525","","","0.71073","MoKα","","0.1199","0.0805","","0.1224","0.0878","0.0878","","","","","","1.0727","","","","has coordinates,has disorder","176435","2020-10-21","18:00:00",""
"1506740","9.3647","0.0007","10.3859","0.0007","13.1874","0.0008","90","","91.777","0.004","90","","1282","0.15","100","2","100","2","","","","","","","Synthesized by the authors. See text","6","P 1 n 1","P -2yac","7","","","","- C10 H11 F3 N2 O3 S -","- C10 H11 F3 N2 O3 S -","- C40 H44 F12 N8 O12 S4 -","4","2","","Charette, André B; Mathieu, Simon; Martel, Jonathan","Electrophilic activation of lactams with Tf2O and pyridine: expedient synthesis of (+/-)-tetraponerine T4.","Organic letters","2005","7","24","5401","5404","10.1021/ol052069n","","","1.54178","CuKα","","0.0709","0.0632","","","0.1686","0.176","","","","","","1.07","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506741","14.174","0.002","11.5857","0.0017","12.0325","0.0018","90","","90","","90","","1975.9","0.5","293","2","293","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C18 H26 Cl2 N2 O2 -","- C18 H26 Cl2 N2 O2 -","- C72 H104 Cl8 N8 O8 -","4","1","","Lim, Yeon-Hee; Li, Tindy; Chen, Peiling; Schreiber, Patrick; Kuznetsova, Larissa; Carroll, Patrick J.; Lauher, Joseph W.; Sieburth, Scott McN","Asymmetry by electrophilic rearrangement of symmetric 2-pyridone photodimers.","Organic letters","2005","7","24","5413","5415","10.1021/ol052071e","","","0.71073","MoKα","","0.1306","0.0533","","","0.1322","0.1569","","","","","","0.97","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506742","12.8244","0.0017","16.1213","0.0018","12.0929","0.0014","90","","90","","90","","2500.2","0.5","143","1","143","1","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C24 H38 Cl2 N2 O2 -","- C24 H38 Cl2 N2 O2 -","- C96 H152 Cl8 N8 O8 -","4","1","","Lim, Yeon-Hee; Li, Tindy; Chen, Peiling; Schreiber, Patrick; Kuznetsova, Larissa; Carroll, Patrick J.; Lauher, Joseph W.; Sieburth, Scott McN","Asymmetry by electrophilic rearrangement of symmetric 2-pyridone photodimers.","Organic letters","2005","7","24","5413","5415","10.1021/ol052071e","","","0.71069","MoKα","","0.054","0.0462","","","0.1344","0.1706","","","","","","1.116","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506743","25.354","0.002","25.354","0.002","18.437","0.002","90","","90","","120","","10263.9","1.6","143","1","143","1","","","","","","","","5","R -3 :H","-R 3","148","","","","- C20 H31 Cl N2 O3 -","- C20 H31 Cl N2 O3 -","- C360 H558 Cl18 N36 O54 -","18","1","","Lim, Yeon-Hee; Li, Tindy; Chen, Peiling; Schreiber, Patrick; Kuznetsova, Larissa; Carroll, Patrick J.; Lauher, Joseph W.; Sieburth, Scott McN","Asymmetry by electrophilic rearrangement of symmetric 2-pyridone photodimers.","Organic letters","2005","7","24","5413","5415","10.1021/ol052071e","","","0.71069","MoKα","","0.0762","0.0707","","","0.198","0.2048","","","","","","1.082","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506744","13.3595","0.0019","13.797","0.002","16.4","0.002","90","","90","","90","","3022.9","0.7","193","2","193","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C26 H42 Cl3 Cr N2 O3 -","- C26 H42 Cl3 Cr N2 O3 -","- C104 H168 Cl12 Cr4 N8 O12 -","4","1","","Namba, Kosuke; Wang, Jiashi; Cui, Sheng; Kishi, Yoshito","Surprisingly efficient catalytic Cr-mediated coupling reactions.","Organic letters","2005","7","24","5421","5424","10.1021/ol052085k","","x-ray","0.71073","MoKα","","0.0854","0.0697","","","0.1555","0.164","","","","","","1.124","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506745","13.7216","0.0002","14.7569","0.0002","15.8442","0.0003","90","","90","","90","","3208.26","0.09","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C29 H45 Br3 O6 -","- C29 H45 Br3 O6 -","- C116 H180 Br12 O24 -","4","1","","Kubanek, Julia; Prusak, Anne C.; Snell, Terry W.; Giese, Rachel A.; Hardcastle, Kenneth I.; Fairchild, Craig R.; Aalbersberg, William; Raventos-Suarez, Carmen; Hay, Mark E.","Antineoplastic diterpene-benzoate macrolides from the Fijian red alga Callophycus serratus.","Organic letters","2005","7","23","5261","5264","10.1021/ol052121f","","","1.54178","CuKα","","0.0338","0.0322","","","0.0803","0.0812","","","","","","1.088","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506746","11.924","0.003","13.948","0.003","21.755","0.005","90","","90","","90","","3618.2","1.5","173","2","173","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30.5 H51 Br3 O7.5 -","- C30.5 H51 Br3 O7.5 -","- C122 H204 Br12 O30 -","4","1","","Kubanek, Julia; Prusak, Anne C.; Snell, Terry W.; Giese, Rachel A.; Hardcastle, Kenneth I.; Fairchild, Craig R.; Aalbersberg, William; Raventos-Suarez, Carmen; Hay, Mark E.","Antineoplastic diterpene-benzoate macrolides from the Fijian red alga Callophycus serratus.","Organic letters","2005","7","23","5261","5264","10.1021/ol052121f","","","1.54178","CuKα","","0.1265","0.1174","","","0.2729","0.2797","","","","","","1.117","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506747","10.4525","0.0002","21.2119","0.0004","24.7104","0.0004","90","","90","","90","","5478.73","0.17","296.2","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C43 H52 Cl10 Fe N8 O6 -","- C43 H52 Cl10 Fe N8 O6 -","- C172 H208 Cl40 Fe4 N32 O24 -","4","1","","Moriuchi, Toshiyuki; Nagai, Takayoshi; Hirao, Toshikazu","Chirality organization of ferrocenes bearing dipeptide chains of heterochiral sequence.","Organic letters","2005","7","23","5265","5268","10.1021/ol052134t","","","0.7107","MoKα","","","0.0979","","","","0.2677","","","","","","2.033","","","","has coordinates","193981","2020-10-21","18:00:00",""
"1506748","21.0852","0.0005","24.6133","0.0007","10.401","0.0002","90","","90","","90","","5397.9","0.2","277.2","","","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C43 H52 Cl10 Fe N8 O6 -","- C43 H52 Cl10 Fe N8 O6 -","- C172 H208 Cl40 Fe4 N32 O24 -","4","1","","Moriuchi, Toshiyuki; Nagai, Takayoshi; Hirao, Toshikazu","Chirality organization of ferrocenes bearing dipeptide chains of heterochiral sequence.","Organic letters","2005","7","23","5265","5268","10.1021/ol052134t","","","0.7107","MoKα","","","0.096","","","","0.2639","","","","","","2.113","","","","has coordinates","193981","2020-10-21","18:00:00",""
"1506749","10.9029","0.0002","19.5118","0.0003","12.269","0.0001","90","","94.684","0.001","90","","2601.33","0.07","277.2","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H27 Fe N4 O3.5 -","- C24 H27 Fe N4 O3.5 -","- C96 H108 Fe4 N16 O14 -","4","2","","Moriuchi, Toshiyuki; Nagai, Takayoshi; Hirao, Toshikazu","Chirality organization of ferrocenes bearing dipeptide chains of heterochiral sequence.","Organic letters","2005","7","23","5265","5268","10.1021/ol052134t","","","0.7107","MoKα","","","0.0874","","","","0.2285","","","","","","1.349","","","","has coordinates","193981","2020-10-21","18:00:00",""
"1506750","10.9323","0.0002","19.5778","0.0004","12.2868","0.0003","90","","94.683","0.002","90","","2620.97","0.1","277.2","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C24 H27 Fe N4 O3.5 -","- C24 H27 Fe N4 O3.5 -","- C96 H108 Fe4 N16 O14 -","4","2","","Moriuchi, Toshiyuki; Nagai, Takayoshi; Hirao, Toshikazu","Chirality organization of ferrocenes bearing dipeptide chains of heterochiral sequence.","Organic letters","2005","7","23","5265","5268","10.1021/ol052134t","","","0.7107","MoKα","","","0.082","","","","0.2202","","","","","","1.388","","","","has coordinates","193981","2020-10-21","18:00:00",""
"1506751","11.468","0.003","12.662","0.004","13.31","0.004","76.23","0.02","80.61","0.02","89.87","0.02","1850.7","1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Fly051","((R,S)-5-hydroxy-2-morpholino-3-spiro-1'-cyclohexyl-2,3- dihydro-1,4-benzodioxin-6-yl)carboxylic methyl ester :[3h]","","- C19 H25 N O6 -","- C19 H25 N O6 -","- C76 H100 N4 O24 -","4","2","","Xu, Daiwang; Chiaroni, Angèle; Largeron, Martine","A one-pot regiospecific synthesis of highly functionalized 1,4-benzodioxin derivatives from an electrochemically induced Diels-Alder reaction.","Organic letters","2005","7","23","5273","5276","10.1021/ol052146e","","","0.71073","MoKα","","0.0748","0.0433","","","0.1013","0.1156","","","","","","1.023","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506752","9.2481","0.001","17.4891","0.0018","14.302","0.0015","90","","97.552","0.002","90","","2293.2","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H23 Cl O -","- C30 H23 Cl O -","- C120 H92 Cl4 O4 -","4","1","","Liu, Yuanhong; Song, Feijie; Song, Zhiquan; Liu, Meina; Yan, Bin","Gold-catalyzed cyclization of (Z)-2-en-4-yn-1-ols: highly efficient synthesis of fully substituted dihydrofurans and furans.","Organic letters","2005","7","24","5409","5412","10.1021/ol052160r","","","0.71073","MoKα","","0.0875","0.058","","","0.1353","0.1466","","","","","","0.93","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506753","13.8696","0.0019","13.8755","0.0019","13.9159","0.0019","85.57","0.003","60.812","0.002","83.295","0.003","2321.4","0.6","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C52 H52 N6 O5 S -","- C52 H52 N6 O5 S -","- C104 H104 N12 O10 S2 -","2","1","","Sessler, Jonathan L.; Roznyatovskiy, Vladimir; Pantos, G. Dan; Borisova, Natalya E.; Reshetova, Marina D.; Lynch, Vincent M.; Khrustalev, Victor N.; Ustynyuk, Yuri A.","Synthesis and anion binding properties of 2,5-diamidothiophene polypyrrole Schiff base macrocycles.","Organic letters","2005","7","23","5277","5280","10.1021/ol052162b","","","0.71073","MoKα","","0.0587","0.0454","","","0.1005","0.1072","","","","","","1.007","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506754","11.4304","0.0002","18.0089","0.0004","21.9615","0.0006","100.204","0.001","104.918","0.001","99.903","0.001","4185.25","0.17","153","2","153","2","","","","","","","","6","P -1","-P 1","2","","","","- C97 H89 Cl3 N12 O4 S2 -","- C97 H89 Cl3 N12 O4 S2 -","- C194 H178 Cl6 N24 O8 S4 -","2","1","","Sessler, Jonathan L.; Roznyatovskiy, Vladimir; Pantos, G. Dan; Borisova, Natalya E.; Reshetova, Marina D.; Lynch, Vincent M.; Khrustalev, Victor N.; Ustynyuk, Yuri A.","Synthesis and anion binding properties of 2,5-diamidothiophene polypyrrole Schiff base macrocycles.","Organic letters","2005","7","23","5277","5280","10.1021/ol052162b","","","0.71073","MoKα","","0.2203","0.0802","","","0.1521","0.1809","","","","","","1.183","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506755","11.1606","0.0002","15.0164","0.0003","16.1627","0.0004","75.206","0.001","71.898","0.001","69.268","0.001","2375.54","0.09","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H56 N6 O4 S -","- C51 H50 N6 O3 S -","- C102 H100 N12 O6 S2 -","2","1","","Sessler, Jonathan L.; Roznyatovskiy, Vladimir; Pantos, G. Dan; Borisova, Natalya E.; Reshetova, Marina D.; Lynch, Vincent M.; Khrustalev, Victor N.; Ustynyuk, Yuri A.","Synthesis and anion binding properties of 2,5-diamidothiophene polypyrrole Schiff base macrocycles.","Organic letters","2005","7","23","5277","5280","10.1021/ol052162b","","","0.71073","MoKα","","0.2467","0.0707","","","0.1336","0.1565","","","","","","0.963","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506756","14.368","0.002","9.905","0.002","16.546","0.002","90","","111.17","0.02","90","","2195.8","0.7","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H21 N O S -","- C28 H21 N O S -","- C112 H84 N4 O4 S4 -","4","1","","Alajarín, Mateo; Ortín, María-Mar; Sánchez-Andrada, Pilar; Vidal, Angel; Bautista, Delia","From ketenimines to ketenes to quinolones: two consecutive pseudopericyclic events.","Organic letters","2005","7","23","5281","5284","10.1021/ol052189v","","","0.71073","MoKα","","0.06","0.0367","","","0.0809","0.0866","","","","","","0.927","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506757","22.577","0.005","20.294","0.004","37.95","0.008","90","","92.06","0.03","90","","17377","6","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C82 H150 F10 N8 O S3 -","- C164 H116 F20 N8 S6 -","- C656 H464 F80 N32 S24 -","4","1","","Rath, Harapriya; Sankar, Jeyaraman; PrabhuRaja, Viswanathan; Chandrashekar, Tavarekere K.; Joshi, Bhawani S.","Aromatic core-modified twisted heptaphyrins[1.1.1.1.1.1.0]: syntheses and structural characterization.","Organic letters","2005","7","24","5445","5448","10.1021/ol0521937","","","0.71073","MoKα","","0.2069","0.1034","","","0.2533","0.2986","","","","","","0.9","","","","has coordinates","194547","2020-10-21","18:00:00",""
"1506758","17.979","0.002","10.718","0.001","11.977","0.001","90","","104.943","0.008","90","","2229.9","0.4","298.2","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H25 N -","- C30 H25 N -","- C120 H100 N4 -","4","1","","Kanno, Ken-ichiro; Liu, Yuanhong; Iesato, Atsushi; Nakajima, Kiyohiko; Takahashi, Tamotsu","Chromium-mediated synthesis of polycyclic aromatic compounds from halobiaryls.","Organic letters","2005","7","24","5453","5456","10.1021/ol052214x","","","1.5418","CuKα","","","0.0984","","","","0.1373","","","","","","3.383","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506759","10.162","0.002","11.205","0.002","27.271","0.005","90","","90","","90","","3105.2","1","300","2","300","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C19 H19 N O2 -","- C19 H19 N O2 -","- C152 H152 N8 O16 -","8","1","","Xue, Dong; Chen, Ying-Chun; Wang, Qi-Wei; Cun, Ling-Feng; Zhu, Jin; Deng, Jin-Gen","Asymmetric direct vinylogous Michael reaction of activated alkenes to nitroolefins catalyzed by modified cinchona alkaloids.","Organic letters","2005","7","23","5293","5296","10.1021/ol052283b","","","0.71073","MoKα","","0.1027","0.0412","","","0.0766","0.0896","","","","","","0.847","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506760","8.829","0.001","8.999","0.001","20.21","0.002","78.48","0.01","88.69","0.01","84.74","0.01","1566.7","0.3","287","2","287","2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H16 N2 -","- C20 H16 N2 -","- C80 H64 N8 -","4","2","","Xue, Dong; Chen, Ying-Chun; Wang, Qi-Wei; Cun, Ling-Feng; Zhu, Jin; Deng, Jin-Gen","Asymmetric direct vinylogous Michael reaction of activated alkenes to nitroolefins catalyzed by modified cinchona alkaloids.","Organic letters","2005","7","23","5293","5296","10.1021/ol052283b","","","0.71073","MoKα","","0.1113","0.0594","","","0.1624","0.1836","","","","","","0.87","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506761","9.153","0.001","12.666","0.002","15.801","0.002","90","","90","","90","","1831.8","0.4","288","2","288","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H16 Cl N3 O2 -","- C21 H16 Cl N3 O2 -","- C84 H64 Cl4 N12 O8 -","4","1","","Xue, Dong; Chen, Ying-Chun; Wang, Qi-Wei; Cun, Ling-Feng; Zhu, Jin; Deng, Jin-Gen","Asymmetric direct vinylogous Michael reaction of activated alkenes to nitroolefins catalyzed by modified cinchona alkaloids.","Organic letters","2005","7","23","5293","5296","10.1021/ol052283b","","","0.71073","MoKα","","0.0716","0.046","","","0.1045","0.1138","","","","","","0.966","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506762","7.074","0.001","15.601","0.002","17.909","0.003","90","","91.76","0.02","90","","1975.5","0.5","287","2","287","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H19 N3 O3 -","- C22 H19 N3 O3 -","- C88 H76 N12 O12 -","4","1","","Xue, Dong; Chen, Ying-Chun; Wang, Qi-Wei; Cun, Ling-Feng; Zhu, Jin; Deng, Jin-Gen","Asymmetric direct vinylogous Michael reaction of activated alkenes to nitroolefins catalyzed by modified cinchona alkaloids.","Organic letters","2005","7","23","5293","5296","10.1021/ol052283b","","","0.71073","MoKα","","0.0858","0.0416","","","0.0928","0.1048","","","","","","0.878","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506763","21.0502","0.0008","8.8331","0.0003","18.6791","0.0006","90","","107.3","0.002","90","","3316","0.2","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H25 N O5 -","- C17 H25 N O5 -","- C136 H200 N8 O40 -","8","1","","Denmark, Scott E.; Baiazitov, Ramil Y.","Intramolecular [4 + 2] cycloaddition of nitroalkenes for construction of vicinal quaternary stereocenters.","Organic letters","2005","7","25","5617","5620","10.1021/ol052316n","","","0.71073","MoKα","","0.0989","0.042","","","0.0805","0.0924","","","","","","0.873","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1506764","10.5451","0.0004","14.2808","0.0006","10.7325","0.0004","90","","90.125","0.002","90","","1616.23","0.11","193","2","193","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H25 N O5 -","- C17 H25 N O5 -","- C68 H100 N4 O20 -","4","1","","Denmark, Scott E.; Baiazitov, Ramil Y.","Intramolecular [4 + 2] cycloaddition of nitroalkenes for construction of vicinal quaternary stereocenters.","Organic letters","2005","7","25","5617","5620","10.1021/ol052316n","","","0.71073","MoKα","","0.0807","0.0409","","","0.0812","0.0908","","","","","","0.886","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1506765","8.0399","0.0016","14.829","0.003","22.669","0.005","105.23","0.03","100.18","0.03","93.56","0.03","2549.9","1.1","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C61 H64 B2 S2 -","- C61 H64 B2 S2 -","- C122 H128 B4 S4 -","2","1","","Liu, Zhi-Qiang; Shi, Mei; Li, Fu-You; Fang, Qi; Chen, Zhang-Hai; Yi, Tao; Huang, Chun-Hui","Highly selective two-photon chemosensors for fluoride derived from organic boranes.","Organic letters","2005","7","24","5481","5484","10.1021/ol052323b","","","0.71073","MoKα","","0.272","0.145","","","0.2487","0.3007","","","","","","1.135","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506766","9.686","0.004","23.733","0.009","25.31","0.009","90","","90","","90","","5818","4","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C34 H40 Fe2 N2 O4 -","- C34 H40 Fe2 N2 O4 -","- C272 H320 Fe16 N16 O32 -","8","2","","Fukuzawa, Shin-ichi; Yahara, Yuusuke; Kamiyama, Akira; Hara, Masumi; Kikuchi, Satoshi","Stereoselective pinacol coupling of chiral formylferrocene using divalent samarium triflate: preparation of a new chiral bisferrocenyl oxazoline ligand and its application to asymmetric Diels-Alder reactions.","Organic letters","2005","7","26","5809","5812","10.1021/ol0523291","","","0.7107","MoKα","","","0.053","","","","0.054","","","","","","1.028","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506767","12.647","0.003","11.666","0.003","20.496","0.005","90","","95.638","0.004","90","","3009.3","1.3","123.1","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C34 H40 Fe2 N2 O4 -","- C34 H38 Fe2 N2 O4 -","- C136 H152 Fe8 N8 O16 -","4","2","","Fukuzawa, Shin-ichi; Yahara, Yuusuke; Kamiyama, Akira; Hara, Masumi; Kikuchi, Satoshi","Stereoselective pinacol coupling of chiral formylferrocene using divalent samarium triflate: preparation of a new chiral bisferrocenyl oxazoline ligand and its application to asymmetric Diels-Alder reactions.","Organic letters","2005","7","26","5809","5812","10.1021/ol0523291","","","0.7107","MoKα","","","0.061","","","","0.062","","","","","","1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506768","11.484","0.005","12.169","0.006","18.868","0.009","90","","90","","90","","2637","2","123.1","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H40 Fe2 N2 O2 -","- C30 H40 Fe2 N2 O2 -","- C120 H160 Fe8 N8 O8 -","4","1","","Fukuzawa, Shin-ichi; Yahara, Yuusuke; Kamiyama, Akira; Hara, Masumi; Kikuchi, Satoshi","Stereoselective pinacol coupling of chiral formylferrocene using divalent samarium triflate: preparation of a new chiral bisferrocenyl oxazoline ligand and its application to asymmetric Diels-Alder reactions.","Organic letters","2005","7","26","5809","5812","10.1021/ol0523291","","","0.7107","MoKα","","","0.061","","","","0.062","","","","","","1","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506769","12.632","0.008","7.864","0.004","14.964","0.01","90","","101.258","0.007","90","","1457.9","1.5","173","2","173","2","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C16 H8 Se4 -","- C16 H8 Se4 -","- C64 H32 Se16 -","4","1","","Okamoto, Toshihiro; Kudoh, Kenichi; Wakamiya, Atsushi; Yamaguchi, Shigehiro","General synthesis of thiophene and selenophene-based heteroacenes.","Organic letters","2005","7","23","5301","5304","10.1021/ol0523650","","","0.7107","MoKα","","0.0521","0.051","","","0.1309","0.132","","","","","","1.085","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506770","7.933","0.004","26.589","0.015","5.906","0.003","90","","90","","90","","1245.8","1.1","173","2","173","2","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C16 H8 S3 -","- C16 H8 S3 -","- C64 H32 S12 -","4","0.5","","Okamoto, Toshihiro; Kudoh, Kenichi; Wakamiya, Atsushi; Yamaguchi, Shigehiro","General synthesis of thiophene and selenophene-based heteroacenes.","Organic letters","2005","7","23","5301","5304","10.1021/ol0523650","","","0.7107","MoKα","","0.0422","0.0417","","","0.0913","0.0915","","","","","","1.218","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506771","11.014","0.001","13.147","0.002","4.8355","0.0006","95.35","0.01","97.18","0.01","113.337","0.008","629.98","0.15","296.2","","","","","","","","","","","4","P -1","-P 1","2","","","","- C13 H15 N O4 -","- C13 H15 N O4 -","- C26 H30 N2 O8 -","2","1","","Minami, Kimi; Kawamura, Yasufumi; Koga, Koichi; Hosokawa, Takahiro","Palladium(II)-catalyzed oxidative transformation of allylic alcohols and vinyl ethers into 2-alkoxytetrahydrofurans: catechol as an activator of catalyst.","Organic letters","2005","7","25","5689","5692","10.1021/ol052377l","","","0.7107","MoKα","","","0.0607","","","","0.2061","","","","","","1.498","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506772","19.238","0.004","12.755","0.003","15.148","0.003","90","","124.62","0.01","90","","3058.9","1.2","298.2","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C16 H19 N O5 -","- C16 H19 N O5 -","- C128 H152 N8 O40 -","8","1","","Minami, Kimi; Kawamura, Yasufumi; Koga, Koichi; Hosokawa, Takahiro","Palladium(II)-catalyzed oxidative transformation of allylic alcohols and vinyl ethers into 2-alkoxytetrahydrofurans: catechol as an activator of catalyst.","Organic letters","2005","7","25","5689","5692","10.1021/ol052377l","","","0.7107","MoKα","","","0.0523","","","","0.1634","","","","","","0.991","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506773","7.6022","0.0001","9.2365","0.0002","12.431","0.0002","102.263","0.001","96.458","0.001","100.565","0.001","828.02","0.03","100","2","100","2","","","","","","","Synthesized by the authors. See text","4","P -1","-P 1","2","","","","- C18 H26 N2 O3 -","- C18 H26 N2 O3 -","- C36 H52 N4 O6 -","2","1","","Sales, Marcelo; Charette, André B","A Diels-Alder approach to the stereoselective synthesis of 2,3,5,6-tetra- and 2,3,4,5,6-pentasubstituted piperidines.","Organic letters","2005","7","26","5773","5776","10.1021/ol052436v","","","1.54178","CuKα","","0.0489","0.0457","","","0.1356","0.1391","","","","","","1.034","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506774","10.685","0.003","24.806","0.006","8.872","0.002","90","","108.68","0.03","90","","2227.7","1","293","2","293","2","","","","","","","Synthesized by the authors. See text","4","C 1 c 1","C -2yc","9","","","","- C24 H33 N O4 -","- C24 H33 N O4 -","- C96 H132 N4 O16 -","4","1","","Sales, Marcelo; Charette, André B","A Diels-Alder approach to the stereoselective synthesis of 2,3,5,6-tetra- and 2,3,4,5,6-pentasubstituted piperidines.","Organic letters","2005","7","26","5773","5776","10.1021/ol052436v","","","1.54178","CuKα","","0.0518","0.0418","","","0.0891","0.0921","","","","","","1.021","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506775","9.2671","0.0013","14.343","0.002","12.2312","0.0017","90","","95.604","0.002","90","","1618","0.4","163","2","163","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H60 O Si3 -","- C27 H59 O Si3 -","- C54 H118 O2 Si6 -","2","1","","Cleary, Pamela A.; Woerpel, K. A.","Metal-catalyzed rearrangement of homoallylic ethers to silylmethyl allylic silanes in the presence of a Di-tert-butylsilylene source.","Organic letters","2005","7","24","5531","5533","10.1021/ol052456x","","","0.71073","MoKα","","0.1215","0.1043","","","0.2569","0.2778","","","","","","1.094","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506776","15.45","0.004","9.102","0.002","15.6427","0.0004","90","","109.702","0.004","90","","2071","0.7","113.2","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C27 H20 O6 -","- C27 H20 O6 -","- C108 H80 O24 -","4","1","","Lumb, Jean-Philip; Trauner, Dirk","Pericyclic reactions of prenylated naphthoquinones: biomimetic syntheses of mollugin and microphyllaquinone.","Organic letters","2005","7","26","5865","5868","10.1021/ol052472u","","","0.7107","MoKα","","0.209","0.0908","","0.1194","","0.0997","","","","","","2.331","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506777","8.798","0.002","9.098","0.002","13.336","0.003","85.941","0.004","80.845","0.003","88.91","0.004","1051.2","0.4","113.2","","","","","","","","","","","3","P -1","-P 1","2","","","","- C27 H19 O6 -","- C27 H17 O6 -","- C54 H34 O12 -","2","1","","Lumb, Jean-Philip; Trauner, Dirk","Pericyclic reactions of prenylated naphthoquinones: biomimetic syntheses of mollugin and microphyllaquinone.","Organic letters","2005","7","26","5865","5868","10.1021/ol052472u","","","0.7107","MoKα","","0.1293","0.0777","","0.1062","","0.098","","","","","","3.228","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506778","30.718","0.003","6.6546","0.0006","26.833","0.003","90","","105.942","0.002","90","","5274.1","0.9","150","","150","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C28 H31 Br O3 Si -","- C28 H31 Br O3 Si -","- C224 H248 Br8 O24 Si8 -","8","1","","Sasaki, Michiko; Higashi, Mariko; Masu, Hyuma; Yamaguchi, Kentaro; Takeda, Kei","Asymmetric [2,3]-Wittig rearrangement induced by a chiral carbanion whose chirality was transferred from an epoxide.","Organic letters","2005","7","26","5913","5915","10.1021/ol052544h","","","0.71073","MoKα","","0.1402","0.0669","","","0.1672","0.208","","","","","","1.04","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506779","14.219","0.009","17.256","0.01","19.305","0.012","90","","90","","90","","4737","5","180","2","180","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C40 H41 Cl10 N2 O2 Rh S -","- C40 H41 Cl10 N2 O2 Rh S -","- C160 H164 Cl40 N8 O8 Rh4 S4 -","4","1","","Matharu, Daljit S.; Morris, David J.; Kawamoto, Aparecida M.; Clarkson, Guy J.; Wills, Martin","A stereochemically well-defined rhodium(III) catalyst for asymmetric transfer hydrogenation of ketones.","Organic letters","2005","7","24","5489","5491","10.1021/ol052559f","","","0.71073","MoKα","","0.13","0.057","","","0.1279","0.1641","","","","","","0.973","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1506780","6.3947","0.0002","9.4295","0.0002","21.418","0.0005","90","","96.469","0.001","90","","1283.26","0.06","150","2","150","2","","","","","","","Hon Lam. No reaction number given.","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H19 N O3 -","- C14 H19 N O3 -","- C56 H76 N4 O12 -","4","1","","Lam, Hon Wai; Murray, Gordon J.; Firth, James D.","Diastereoselective synthesis of 4-hydroxypiperidin-2-ones via Cu(I)-catalyzed reductive aldol cyclization.","Organic letters","2005","7","25","5743","5746","10.1021/ol052599j","","","0.71073","MoKα","","0.0664","0.0548","","","0.1318","0.1384","","","","","","1.118","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506781","20.693","0.002","5.8798","0.0007","13.1078","0.0018","90","","98.577","0.007","90","","1577","0.3","150","2","150","2","","","","","","","Hon Lam, reaction 1/35/2","4","P 1 21/c 1","-P 2ybc","14","","","","- C19 H21 N O3 -","- C19 H21 N O3 -","- C76 H84 N4 O12 -","4","1","","Lam, Hon Wai; Murray, Gordon J.; Firth, James D.","Diastereoselective synthesis of 4-hydroxypiperidin-2-ones via Cu(I)-catalyzed reductive aldol cyclization.","Organic letters","2005","7","25","5743","5746","10.1021/ol052599j","","","0.71073","MoKα","","0.0681","0.047","","","0.1232","0.1326","","","","","","1.041","","","","has coordinates","211332","2020-10-21","18:00:00",""
"1506782","20.3081","0.0008","6.8444","0.0003","10.4444","0.0005","90","","98.961","0.003","90","","1434.02","0.11","150","","150","","","","","","","","H. Lam","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H21 N O3 -","- C15 H21 N O3 -","- C60 H84 N4 O12 -","4","1","","Lam, Hon Wai; Murray, Gordon J.; Firth, James D.","Diastereoselective synthesis of 4-hydroxypiperidin-2-ones via Cu(I)-catalyzed reductive aldol cyclization.","Organic letters","2005","7","25","5743","5746","10.1021/ol052599j","","","0.71073","MoKα","","0.0795","0.0547","","0.1294","0.1179","0.1294","","","","","","0.9818","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506783","20.655","0.0003","6.0188","0.0001","13.3363","0.0002","90","","97.128","0.001","90","","1645.13","0.04","150","","150","","","","","","","","G. Murray","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H23 N O3 -","- C20 H23 N O3 -","- C80 H92 N4 O12 -","4","1","","Lam, Hon Wai; Murray, Gordon J.; Firth, James D.","Diastereoselective synthesis of 4-hydroxypiperidin-2-ones via Cu(I)-catalyzed reductive aldol cyclization.","Organic letters","2005","7","25","5743","5746","10.1021/ol052599j","","","0.71073","MoKα","","0.0811","0.0558","","0.1297","0.1184","0.1297","","","","","","0.9474","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1506784","6.4784","0.0005","9.8027","0.0009","26.807","0.003","90","","90","","90","","1702.4","0.3","150","","150","","","","","","","","G. Murray","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H23 N O5 -","- C17 H23 N O5 -","- C68 H92 N4 O20 -","4","1","","Lam, Hon Wai; Murray, Gordon J.; Firth, James D.","Diastereoselective synthesis of 4-hydroxypiperidin-2-ones via Cu(I)-catalyzed reductive aldol cyclization.","Organic letters","2005","7","25","5743","5746","10.1021/ol052599j","","","0.71073","MoKα","","0.0743","0.0442","","0.1042","0.0905","0.1042","","","","","","0.941","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506785","6.5512","0.0013","17.231","0.004","8.6956","0.0018","90","","104.558","0.003","90","","950.1","0.4","150","","150","","","","","","","","G. Murray","4","P 1 21 1","P 2yb","4","","","","- C20 H27 N O5 -","- C20 H27 N O5 -","- C40 H54 N2 O10 -","2","1","","Lam, Hon Wai; Murray, Gordon J.; Firth, James D.","Diastereoselective synthesis of 4-hydroxypiperidin-2-ones via Cu(I)-catalyzed reductive aldol cyclization.","Organic letters","2005","7","25","5743","5746","10.1021/ol052599j","","","0.71073","MoKα","","0.0649","0.0516","","0.1099","0.1036","0.1099","","","","","","1.0371","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506786","9.757","0.003","10.425","0.003","11.465","0.004","90","","90","","90","","1166.2","0.6","207","2","207","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H20 O2 -","- C13 H20 O2 -","- C52 H80 O8 -","4","1","","Lavigne, Roch M. A.; Riou, Maxime; Girardin, Mélina; Morency, Louis; Barriault, Louis","Synthesis of highly functionalized bicyclo[m.n.1]alkanones via a cationic reaction cascade.","Organic letters","2005","7","26","5921","5923","10.1021/ol0527072","","","0.71073","MoKα","","0.0415","0.0368","","","0.0835","0.0854","","","","","","1.052","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1506787","6.444","0.003","11.881","0.005","17.404","0.007","104.598","0.008","90.33","0.009","93.691","0.009","1286.4","1","207","2","207","2","","","","","","","","3","P -1","-P 1","2","","","","- C31 H36 O6 -","- C31 H36 O6 -","- C62 H72 O12 -","2","1","","Lavigne, Roch M. A.; Riou, Maxime; Girardin, Mélina; Morency, Louis; Barriault, Louis","Synthesis of highly functionalized bicyclo[m.n.1]alkanones via a cationic reaction cascade.","Organic letters","2005","7","26","5921","5923","10.1021/ol0527072","","","0.71073","MoKα","","0.1335","0.1068","","","0.2915","0.3058","","","","","","1.163","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1506788","11.07","0.005","18.754","0.009","8.287","0.004","90","","90","","90","","1720.4","1.4","207","2","207","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C20 H28 O3 -","- C20 H28 O3 -","- C80 H112 O12 -","4","1","","Lavigne, Roch M. A.; Riou, Maxime; Girardin, Mélina; Morency, Louis; Barriault, Louis","Synthesis of highly functionalized bicyclo[m.n.1]alkanones via a cationic reaction cascade.","Organic letters","2005","7","26","5921","5923","10.1021/ol0527072","","","0.71073","MoKα","","0.0869","0.0544","","","0.0935","0.1032","","","","","","1.007","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1513309","38.544","0.022","8.2161","0.0039","26.46","0.015","90","","120.605","0.009","90","","7212","7","293.1","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C41 H34 N4 O2 S -","- C41 H30 N4 O2 S -","- C328 H240 N32 O16 S8 -","8","1","","Kozaki, Masatoshi; Isoyama, Asuka; Akita, Kogen; Okada, Keiji","Preparation, Properties, and Reduction of Heteroaromatic Quinoids with 1,4-Diazacyclopentadien-2-ylidene Terminals","Organic Letters","2005","7","1","115","118","10.1021/ol0476927","","","0.7107","MoKα","","","0.075","","","","0.082","","","","","","1.122","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1517081","11.8347","0.0002","12.6758","0.0002","12.9917","0.0002","83.604","0.001","84.093","0.001","65.322","0.001","1756.48","0.05","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H16 Br N O2 -","- C21 H16 Br N O2 -","- C84 H64 Br4 N4 O8 -","4","2","","Goldberg, Frederick W.; Magnus, Philip; Turnbull, Rachel","A mild thermal and acid-catalyzed rearrangement of O-aryl ethers into ortho-hydroxy arenes.","Organic letters","2005","7","20","4531","4534","10.1021/ol051943+","","","0.71073","MoKα","","0.0675","0.0416","","","0.0954","0.1073","","","","","","1.008","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517082","8.4348","0.0008","14.1792","0.0018","14.812","0.002","94.72","0.008","91.124","0.006","105.433","0.013","1700.2","0.4","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H16 Br N O2 -","- C21 H16 Br N O2 -","- C84 H64 Br4 N4 O8 -","4","2","","Goldberg, Frederick W.; Magnus, Philip; Turnbull, Rachel","A mild thermal and acid-catalyzed rearrangement of O-aryl ethers into ortho-hydroxy arenes.","Organic letters","2005","7","20","4531","4534","10.1021/ol051943+","","","0.71073","MoKα","","0.2754","0.1035","","","0.128","0.1608","","","","","","1.241","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517083","7.841","0.0002","13.755","0.0005","17.44","0.0009","90","","90","","90","","1880.96","0.13","298","","","","","","","","","","synthetic","4","P c 21 b","P -2bc -2c","29","","(4aS,8S,8aS)-4,7,8a-trimethyl-8-[(p-methylphenylsulfonyl)methyl]- 1,2,4a,5,8,8a-hexahydronaphthalene","","- C21 H28 O2 S -","- C21 H28 O2 S -","- C84 H112 O8 S4 -","4","1","","Imagawa, Hiroshi; Iyenaga, Tomoaki; Nishizawa, Mugio","Mercuric triflate-catalyzed tandem cyclization leading to polycarbocycles.","Organic letters","2005","7","3","451","453","10.1021/ol047472t","","","0.71073","MoKα","","0.0462","0.0436","","","0.1228","0.1316","","","","","","1.193","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1517084","7.286","0.0004","10.506","0.0007","10.585","0.0009","107.314","0.003","99.739","0.003","102.947","0.003","729.25","0.09","298","","","","","","","","","","synthetic","3","P -1","-P 1","2","","(6aS,10aS)-1,3-dimethoxy-7,10a-dimethyl- 6a,9,10,10a-tetrahydro-6H-benzo[c]chromene","","- C17 H22 O3 -","- C17 H22 O3 -","- C34 H44 O6 -","2","1","","Imagawa, Hiroshi; Iyenaga, Tomoaki; Nishizawa, Mugio","Mercuric triflate-catalyzed tandem cyclization leading to polycarbocycles.","Organic letters","2005","7","3","451","453","10.1021/ol047472t","","","0.71073","MoKα","","0.0637","0.0516","","","0.149","0.1702","","","","","","1.092","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1517085","9.1575","0.0014","13.84","0.002","14.879","0.002","90","","90","","90","","1885.8","0.5","273","2","273","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 N2 O5 -","- C20 H20 N2 O5 -","- C80 H80 N8 O20 -","4","1","","Nair, Vijay; Biju, A. T.; Abhilash, K. G.; Menon, Rajeev S.; Suresh, Eringathodi","Reaction of diaryl-1,2-diones with triphenylphosphine and diethyl azodicarboxylate leading to N,N-dicarboethoxy monohydrazones via a novel rearrangement.","Organic letters","2005","7","11","2121","2123","10.1021/ol050403+","","","0.71073","MoKα","","0.0473","0.0421","","","0.1099","0.1142","","","","","","1.03","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517086","19.4695","0.001","19.4695","0.001","26.58","0.002","90","","90","","90","","10075.5","1.1","170","2","170","2","","","","","","","","3","P 41 2 2","P 4w 2c","91","2","1,10-dihydroxybicyclo[8.8.8] hexacosane","","- C26 H50 O2 -","- C26 H50 O2 -","- C416 H800 O32 -","16","2","","Jones, Ian W.; Monguchi, Yasunari; Dawson, Alice; Carducci, Michael D.; Mash, Eugene A.","Synthesis of 1,10-dimethylbicyclo[8.8.8]hexacosane and 1,10-dihydroxybicyclo[8.8.8]hexacosane.","Organic letters","2005","7","14","2841","2843","10.1021/ol050714k","","","0.71073","MoKα","","0.147","0.0945","","","0.2439","0.3052","","","","","","1.028","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1517087","10.639","0.003","27.103","0.008","10.096","0.003","90","","116.417","0.005","90","","2607.2","1.3","173","2","173","2","","","","","","","","2","P 1 21/c 1","-P 2ybc","14","1","1,10 dimethyl bicyclo[8.8.8]hexacosane","","- C28 H54 -","- C28 H54 -","- C112 H216 -","4","1","","Jones, Ian W.; Monguchi, Yasunari; Dawson, Alice; Carducci, Michael D.; Mash, Eugene A.","Synthesis of 1,10-dimethylbicyclo[8.8.8]hexacosane and 1,10-dihydroxybicyclo[8.8.8]hexacosane.","Organic letters","2005","7","14","2841","2843","10.1021/ol050714k","","","0.71073","MoKα","","0.1754","0.0688","","","0.1433","0.1856","","","","","","1.007","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517088","8.7677","0.0014","4.8934","0.0008","25.862","0.004","90","","93.889","0.003","90","","1107","0.3","100","2","100","2","","","","","","","","3","P 1 2/c 1","-P 2yc","13","","","","- C20 Cl10 N6 -","- C20 Cl10 N6 -","- C40 Cl20 N12 -","2","0.5","","Zheng, Shijun; Thompson, Joe D.; Tontcheva, Ana; Khan, Saeed I.; Rubin, Yves","Perchloro-2,5,8-triazaphenalenyl radical.","Organic letters","2005","7","9","1861","1863","10.1021/ol050570+","","","0.71073","MoKα","","0.0605","0.0419","","","0.0987","0.1039","","","","","","1","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1517089","6.9473","0.0016","6.2385","0.0015","15.819","0.004","100.097","0.004","97.56","0.004","104.412","0.004","642.6","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C10.5 H2 Cl5 N3 O2 -","- C10.5 H2 Cl5 N3 O2 -","- C21 H4 Cl10 N6 O4 -","2","1","","Zheng, Shijun; Thompson, Joe D.; Tontcheva, Ana; Khan, Saeed I.; Rubin, Yves","Perchloro-2,5,8-triazaphenalenyl radical.","Organic letters","2005","7","9","1861","1863","10.1021/ol050570+","","","0.71073","MoKα","","0.0886","0.0592","","","0.1408","0.1561","","","","","","0.952","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1556110","9.1105","0.0007","9.7461","0.0009","13.7386","0.0011","90","","101.569","0.005","90","","1195.09","0.17","295","","","","","","","","","","","4","P 1 21 1","P 2yb","4","(-)-(R)-3nb","(R)-(-)-6-Acetoxymethyl-2'-bromobiphenyl-2,3,4,5-tetrazcarboxylic acid tetramethyl ester","","- C23 H21 Br O10 -","- C23 H21 Br O10 -","- C46 H42 Br2 O20 -","2","1","","Tanaka, Ken; Nishida, Goushi; Ogino, Masakazu; Hirano, Masao; Noguchi, Keiichi","Enantioselective synthesis of axially chiral biaryls through rhodium-catalyzed complete intermolecular cross-cyclotrimerization of internal alkynes.","Organic letters","2005","7","14","3119","3121","10.1021/ol0511880","","","1.5418","CuKα","","0.0305","0.0287","","","0.078","0.0798","","","","","","1.051","","","","has coordinates","244972","2020-10-21","18:00:00",""
"1556111","11.9029","0.0013","6.4499","0.0004","13.0137","0.0014","90","","99.747","0.013","90","","984.67","0.17","173","","173","1","","","","","","","see text","5","P 1 21 1","P 2yb","4","","","","- C21 H22 Cl N O5 -","- C21 H22 Cl N O5 -","- C42 H44 Cl2 N2 O10 -","2","1","","Weisser, Roland; Yue, Weimin; Reiser, Oliver","Enantioselective synthesis of furo[2,3-b]furans, a spongiane diterpenoid substructure.","Organic letters","2005","7","24","5353","5356","10.1021/ol051457m","","","0.71073","MoKα","","0.0412","0.0308","","","0.0634","0.0658","","","","","","0.894","","","","has coordinates","243473","2020-10-21","18:00:00",""
"1556112","5.7104","0.0005","14.5249","0.0016","20.567","0.002","90","","90","","90","","1705.9","0.3","173","","173","1","","","","","","","see text","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 O5 -","- C20 H20 O5 -","- C80 H80 O20 -","4","1","","Weisser, Roland; Yue, Weimin; Reiser, Oliver","Enantioselective synthesis of furo[2,3-b]furans, a spongiane diterpenoid substructure.","Organic letters","2005","7","24","5353","5356","10.1021/ol051457m","","","0.71073","MoKα","","0.0913","0.0392","","","0.0711","0.0817","","","","","","0.694","","","","has coordinates","243474","2020-10-21","18:00:00",""
"1556113","5.31","0.0006","10.8386","0.001","12.8074","0.0012","90","","90","","90","","737.1","0.13","173","","173","1","","","","","","","see text","3","P 21 21 21","P 2ac 2ab","19","","","","- C7 H8 O5 -","- C7 H8 O5 -","- C28 H32 O20 -","4","1","","Weisser, Roland; Yue, Weimin; Reiser, Oliver","Enantioselective synthesis of furo[2,3-b]furans, a spongiane diterpenoid substructure.","Organic letters","2005","7","24","5353","5356","10.1021/ol051457m","","","0.71073","MoKα","","0.0292","0.0226","","","0.0446","0.0458","","","","","","0.988","","","","has coordinates","243475","2020-10-21","18:00:00",""
"1556114","9.0186","0.001","10.1685","0.0011","10.338","0.0012","106.26","0.007","92.413","0.008","114.734","0.007","812.73","0.17","296","2","296","2","","","","","","","","5","P 1","P 1","1","'(R)-(+)-2-Butyl-1-(2-chlorophenyl)-2,5,6,7- tetrahydro[2]pyrindin-3-one'","","","- C18 H20 Cl N O -","- C18 H20 Cl N O -","- C36 H40 Cl2 N2 O2 -","2","2","","Tanaka, Ken; Wada, Azusa; Noguchi, Keiichi","Rhodium-catalyzed chemo-, regio-, and enantioselective [2 + 2 + 2] cycloaddition of alkynes with isocyanates.","Organic letters","2005","7","21","4737","4739","10.1021/ol052041b","","","1.5418","CuKα","","0.0633","0.0538","","","0.1548","0.169","","","","","","0.996","","","","has coordinates","244972","2020-10-21","18:00:00",""
"4060358","48.05","0.01","6.381","0.001","14.63","0.003","90","","92.22","0.01","90","","4482.3","1.5","293","2","293","2","","","","","","","","4","C 1 2 1","C 2y","5","Canada-12","","","- C25 H33 N O3 -","- C25 H33 N O3 -","- C200 H264 N8 O24 -","8","2","","Xia, Wujiong; Scheffer, John R.; Botoshansky, Mark; Kaftory, Menahem","Photochemistry of 1-Isopropylcycloalkyl Aryl Ketones: Ring Size Effects, Medium Effects, and Asymmetric Induction","Organic Letters","2005","7","7","1315","1318","10.1021/ol050104k","","","","","","","","","","","","","","","","","","","","","has coordinates","219238","2020-10-21","18:00:00",""
"4060359","13.807","0.003","6.34","0.001","26.961","0.005","90","","90","","90","","2360.1","0.8","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Canada-11 XW-168","","","- C26 H35 N O3 -","- C26 H35 N O3 -","- C104 H140 N4 O12 -","4","1","","Xia, Wujiong; Scheffer, John R.; Botoshansky, Mark; Kaftory, Menahem","Photochemistry of 1-Isopropylcycloalkyl Aryl Ketones: Ring Size Effects, Medium Effects, and Asymmetric Induction","Organic Letters","2005","7","7","1315","1318","10.1021/ol050104k","","","","","","","","","","","","","","","","","","","","","has coordinates","277847","2022-09-14","22:28:06",""
"4060360","6.279","0.001","8.183","0.002","16.506","0.003","76.9","0.02","81.73","0.02","68.4","0.02","766.3","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","XW-174-2","","","- C17 H22 O3 -","- C17 H22 O3 -","- C34 H44 O6 -","2","1","","Xia, Wujiong; Scheffer, John R.; Botoshansky, Mark; Kaftory, Menahem","Photochemistry of 1-Isopropylcycloalkyl Aryl Ketones: Ring Size Effects, Medium Effects, and Asymmetric Induction","Organic Letters","2005","7","7","1315","1318","10.1021/ol050104k","","","","","","","","","","","","","","","","","","","","","has coordinates","277847","2022-09-14","22:28:06",""
"4060361","14.05","0.003","6.38","0.001","14.914","0.003","90","","111.01","0.02","90","","1248","0.4","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C27 H37 N O3 -","- C27 H37 N O3 -","- C54 H74 N2 O6 -","2","1","","Xia, Wujiong; Scheffer, John R.; Botoshansky, Mark; Kaftory, Menahem","Photochemistry of 1-Isopropylcycloalkyl Aryl Ketones: Ring Size Effects, Medium Effects, and Asymmetric Induction","Organic Letters","2005","7","7","1315","1318","10.1021/ol050104k","","","","","","","","","","","","","","","","","","","","","has coordinates","219238","2020-10-21","18:00:00",""