# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T05:55:37+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Beilstein journal of organic chemistry') 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
"1529449","9.7442","0.0007","13.1654","0.0012","17.8252","0.0017","90","","93.934","0.004","90","","2281.3","0.3","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H10 Br N -","- C14 H10 Br N -","- C112 H80 Br8 N8 -","8","2","","Messaoud, Mohamed Yacine Ameur; Bentabed-Ababsa, Ghenia; Hedidi, Madani; Derdour, Aïcha; Chevallier, Floris; Halauko, Yury S.; Ivashkevich, Oleg A.; Matulis, Vadim E.; Picot, Laurent; Thiéry, Valérie; Roisnel, Thierry; Dorcet, Vincent; Mongin, Florence","Deproto-metallation of N-arylated pyrroles and indoles using a mixed lithium-zinc base and regioselectivity-computed CH acidity relationship.","Beilstein journal of organic chemistry","2015","11","","1475","1485","10.3762/bjoc.11.160","","x-ray","0.71073","MoKα","","0.1171","0.0822","","","0.2092","0.2264","","","","","","1.102","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529450","7.08","0.0003","20.666","0.001","8.2442","0.0005","90","","100.632","0.002","90","","1185.54","0.11","150","2","150","2","","","","","","","synthesis as described","4","C 1 c 1","C -2yc","9","","","","- C14 H10 I N -","- C14 H10 I N -","- C56 H40 I4 N4 -","4","1","","Messaoud, Mohamed Yacine Ameur; Bentabed-Ababsa, Ghenia; Hedidi, Madani; Derdour, Aïcha; Chevallier, Floris; Halauko, Yury S.; Ivashkevich, Oleg A.; Matulis, Vadim E.; Picot, Laurent; Thiéry, Valérie; Roisnel, Thierry; Dorcet, Vincent; Mongin, Florence","Deproto-metallation of N-arylated pyrroles and indoles using a mixed lithium-zinc base and regioselectivity-computed CH acidity relationship.","Beilstein journal of organic chemistry","2015","11","","1475","1485","10.3762/bjoc.11.160","","x-ray","0.71073","MoKα","","0.0238","0.0233","","","0.0563","0.0566","","","","","","1.1","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1529451","9.9461","0.0004","6.9825","0.0003","15.2049","0.0008","90","","92.314","0.002","90","","1055.1","0.08","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C11 H10 I N O -","- C11 H10 I N O -","- C44 H40 I4 N4 O4 -","4","1","","Messaoud, Mohamed Yacine Ameur; Bentabed-Ababsa, Ghenia; Hedidi, Madani; Derdour, Aïcha; Chevallier, Floris; Halauko, Yury S.; Ivashkevich, Oleg A.; Matulis, Vadim E.; Picot, Laurent; Thiéry, Valérie; Roisnel, Thierry; Dorcet, Vincent; Mongin, Florence","Deproto-metallation of N-arylated pyrroles and indoles using a mixed lithium-zinc base and regioselectivity-computed CH acidity relationship.","Beilstein journal of organic chemistry","2015","11","","1475","1485","10.3762/bjoc.11.160","","x-ray","0.71073","MoKα","","0.0292","0.0253","","","0.0548","0.0567","","","","","","1.083","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1529452","10.0665","0.0005","5.9895","0.0004","17.5155","0.001","90","","103.942","0.003","90","","1024.96","0.1","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H7 Br I N -","- C10 H7 Br I N -","- C40 H28 Br4 I4 N4 -","4","1","","Messaoud, Mohamed Yacine Ameur; Bentabed-Ababsa, Ghenia; Hedidi, Madani; Derdour, Aïcha; Chevallier, Floris; Halauko, Yury S.; Ivashkevich, Oleg A.; Matulis, Vadim E.; Picot, Laurent; Thiéry, Valérie; Roisnel, Thierry; Dorcet, Vincent; Mongin, Florence","Deproto-metallation of N-arylated pyrroles and indoles using a mixed lithium-zinc base and regioselectivity-computed CH acidity relationship.","Beilstein journal of organic chemistry","2015","11","","1475","1485","10.3762/bjoc.11.160","","x-ray","0.71073","MoKα","","0.041","0.032","","","0.0789","0.0828","","","","","","1.034","","","","has coordinates","176428","2020-10-21","18:00:00",""
"1529453","11.4222","0.0006","5.4888","0.0003","19.7338","0.0012","90","","100.562","0.002","90","","1216.23","0.12","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H13 N3 O -","- C14 H13 N3 O -","- C56 H52 N12 O4 -","4","1","","Messaoud, Mohamed Yacine Ameur; Bentabed-Ababsa, Ghenia; Hedidi, Madani; Derdour, Aïcha; Chevallier, Floris; Halauko, Yury S.; Ivashkevich, Oleg A.; Matulis, Vadim E.; Picot, Laurent; Thiéry, Valérie; Roisnel, Thierry; Dorcet, Vincent; Mongin, Florence","Deproto-metallation of N-arylated pyrroles and indoles using a mixed lithium-zinc base and regioselectivity-computed CH acidity relationship.","Beilstein journal of organic chemistry","2015","11","","1475","1485","10.3762/bjoc.11.160","","x-ray","0.71073","MoKα","","0.0505","0.0404","","","0.101","0.1081","","","","","","1.031","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4028968","6.9659","0.0003","7.5441","0.0004","13.4092","0.0005","90.994","0.004","90.947","0.004","106.218","0.005","676.36","0.06","273","2","273","2","","","","","","","","5","P -1","-P 1","2","","","","- C13 H14 Br N3 O2 -","- C13 H14 Br N3 O2 -","- C26 H28 Br2 N6 O4 -","2","1","","Pavlovskaya, Tatyana L.; Yaremenko, Fedor G.; Lipson, Victoria V.; Shishkina, Svetlana V.; Shishkin, Oleg V.; Musatov, Vladimir I.; Karpenko, Alexander S.","The regioselective synthesis of spirooxindolo pyrrolidines and pyrrolizidines via three-component reactions of acrylamides and aroylacrylic acids with isatins and α-amino acids.","Beilstein journal of organic chemistry","2014","10","","117","126","10.3762/bjoc.10.8","","","0.71073","MoKα","","0.0728","0.0464","","","0.1022","0.111","","","","","","1.049","","","","has coordinates","178468","2020-10-21","18:00:00",""
"4028969","8.8751","0.0007","10.5764","0.0009","12.3519","0.001","75.858","0.005","84.297","0.005","76.237","0.005","1090.96","0.16","466","2","466","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H19 Br Cl2 N2 O5 -","- C21 H19 Br Cl2 N2 O5 -","- C42 H38 Br2 Cl4 N4 O10 -","2","1","","Pavlovskaya, Tatyana L.; Yaremenko, Fedor G.; Lipson, Victoria V.; Shishkina, Svetlana V.; Shishkin, Oleg V.; Musatov, Vladimir I.; Karpenko, Alexander S.","The regioselective synthesis of spirooxindolo pyrrolidines and pyrrolizidines via three-component reactions of acrylamides and aroylacrylic acids with isatins and α-amino acids.","Beilstein journal of organic chemistry","2014","10","","117","126","10.3762/bjoc.10.8","","","0.71073","MoKα","","0.082","0.043","","","0.1012","0.1103","","","","","","1.055","","","","has coordinates","178468","2020-10-21","18:00:00",""
"4029324","34.473","0.004","5.5047","0.0004","17.7523","0.0017","90","","101.619","0.01","90","","3299.7","0.6","120","","120","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","4,6,7-Triphenyl-5-oxa-1-azabicyclo[4.1.0]hept-3-en-2-one","","- C23 H17 N O2 -","- C23 H17 N O2 -","- C184 H136 N8 O16 -","8","1","","Khlebnikov, Alexander F.; Novikov, Mikhail S.; Pakalnis, Viktoriia V.; Iakovenko, Roman O.; Yufit, Dmitry S.","Domino reactions of 2H-azirines with acylketenes from furan-2,3-diones: Competition between the formation of ortho-fused and bridged heterocyclic systems.","Beilstein journal of organic chemistry","2014","10","","784","793","10.3762/bjoc.10.74","","","0.7107","MoKα","Mo","0.189","0.0737","","","0.0951","0.1376","","","","","","0.902","","","","has coordinates","178472","2020-10-21","18:00:00",""
"4029325","12.1236","0.0005","18.2526","0.0007","13.4793","0.0005","90","","103.738","0.004","90","","2897.5","0.2","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","(6aRS,12aRS)-6a,12a-Bis(4-methoxyphenyl)-2,8-diphenyl-6,6a,12,12a-tetrahydrobis- [1,3]oxazino[3,2-a:3',2'-d]pyrazine-4,10-dione","","- C36 H30 N2 O6 -","- C36 H30 N2 O6 -","- C144 H120 N8 O24 -","4","1","","Khlebnikov, Alexander F.; Novikov, Mikhail S.; Pakalnis, Viktoriia V.; Iakovenko, Roman O.; Yufit, Dmitry S.","Domino reactions of 2H-azirines with acylketenes from furan-2,3-diones: Competition between the formation of ortho-fused and bridged heterocyclic systems.","Beilstein journal of organic chemistry","2014","10","","784","793","10.3762/bjoc.10.74","","","0.7107","MoKα","Mo","0.0981","0.0567","","","0.1074","0.1284","","","","","","1.043","","","","has coordinates","178472","2020-10-21","18:00:00",""
"4029326","14.56","0.0005","17.9642","0.0006","17.1799","0.0006","90","","105.85","0.001","90","","4322.7","0.3","100","","100","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","4,6,8-Triphenyl-5,7-dioxa-1-azabicyclo[4.4.1]undeca-3,8-diene-2,10-dione","","- C26 H19 N O4 -","- C26 H19 N O4 -","- C208 H152 N8 O32 -","8","2","","Khlebnikov, Alexander F.; Novikov, Mikhail S.; Pakalnis, Viktoriia V.; Iakovenko, Roman O.; Yufit, Dmitry S.","Domino reactions of 2H-azirines with acylketenes from furan-2,3-diones: Competition between the formation of ortho-fused and bridged heterocyclic systems.","Beilstein journal of organic chemistry","2014","10","","784","793","10.3762/bjoc.10.74","","x-ray","1.54178","CuKα","K-L~3~","0.0704","0.044","","","0.0993","0.1073","","","","","","0.991","","","","has coordinates","178472","2020-10-21","18:00:00",""
"4029327","8.062","0.0005","16.422","0.001","16.717","0.001","90","","90","","90","","2213.2","0.2","123","2","123","2","","","","","","","","2","P 21 c a","P -2ac 2a","29","","","","- C37 H20 -","- C37 H20 -","- C148 H80 -","4","1","","Shrestha, Binod Babu; Higashibayashi, Shuhei; Sakurai, Hidehiro","Columnar/herringbone dual crystal packing of pyrenylsumanene and its photophysical properties.","Beilstein journal of organic chemistry","2014","10","","841","847","10.3762/bjoc.10.80","","","0.71069","MoKα","","0.1684","0.0639","","","0.1308","0.1715","","","","","","0.933","","","","has coordinates","178472","2020-10-21","18:00:00",""
"4029421","9.9427","0.0015","16.894","0.003","14.819","0.002","90","","109.195","0.002","90","","2350.8","0.6","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C29 H24 N O2 P -","- C29 H24 N O2 P -","- C116 H96 N4 O8 P4 -","4","1","","Gangadhararao, G.; Kotikalapudi, Ramesh; Nagarjuna Reddy, M.; Swamy, K. C. Kumara","Allenylphosphine oxides as simple scaffolds for phosphinoylindoles and phosphinoylisocoumarins.","Beilstein journal of organic chemistry","2014","10","","996","1005","10.3762/bjoc.10.99","","","0.71073","MoKα","","0.0465","0.0408","","","0.1101","0.114","","","","","","1.074","","","","has coordinates","178473","2020-10-21","18:00:00",""
"4029422","11.2497","0.0006","21.1287","0.0009","15.288","0.0006","90","","90","","90","","3633.8","0.3","293","2","293","2","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C22 H20 N O P -","- C22 H20 N O P -","- C176 H160 N8 O8 P8 -","8","1","","Gangadhararao, G.; Kotikalapudi, Ramesh; Nagarjuna Reddy, M.; Swamy, K. C. Kumara","Allenylphosphine oxides as simple scaffolds for phosphinoylindoles and phosphinoylisocoumarins.","Beilstein journal of organic chemistry","2014","10","","996","1005","10.3762/bjoc.10.99","","","0.71073","MoKα","","0.0537","0.043","","","0.1076","0.1141","","","","","","1.085","","","","has coordinates","178473","2020-10-21","18:00:00",""
"4029423","9.744","0.0019","9.9918","0.0017","10.2864","0.0018","84.229","0.014","76.556","0.016","66.323","0.018","892","0.3","298","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C22 H17 O3 P -","- C22 H17 O3 P -","- C44 H34 O6 P2 -","2","1","","Gangadhararao, G.; Kotikalapudi, Ramesh; Nagarjuna Reddy, M.; Swamy, K. C. Kumara","Allenylphosphine oxides as simple scaffolds for phosphinoylindoles and phosphinoylisocoumarins.","Beilstein journal of organic chemistry","2014","10","","996","1005","10.3762/bjoc.10.99","","","0.71073","MoKα","","0.0686","0.0455","","","0.1114","0.1191","","","","","","1.01","","","","has coordinates","178473","2020-10-21","18:00:00",""
"4029424","7.9413","0.0019","7.9674","0.0019","9.746","0.002","66.05","0.02","79.379","0.019","62.93","0.02","501.8","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H9 Br O2 -","- C11 H9 Br O2 -","- C22 H18 Br2 O4 -","2","1","","Gangadhararao, G.; Kotikalapudi, Ramesh; Nagarjuna Reddy, M.; Swamy, K. C. Kumara","Allenylphosphine oxides as simple scaffolds for phosphinoylindoles and phosphinoylisocoumarins.","Beilstein journal of organic chemistry","2014","10","","996","1005","10.3762/bjoc.10.99","","","0.71073","MoKα","","0.0513","0.0425","","","0.1021","0.1108","","","","","","1.097","","","","has coordinates","178473","2020-10-21","18:00:00",""
"4029596","11.7538","0.0017","11.8065","0.0017","22.371","0.003","90","","90","","90","","3104.5","0.8","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","RO_3-061","","","- C31 H47 N O4 Si -","- C31 H47 N O4 Si -","- C124 H188 N4 O16 Si4 -","4","1","","Ries, Oliver; Büschleb, Martin; Granitzka, Markus; Stalke, Dietmar; Ducho, Christian","Amino acid motifs in natural products: synthesis of O-acylated derivatives of (2S,3S)-3-hydroxyleucine.","Beilstein journal of organic chemistry","2014","10","","1135","1142","10.3762/bjoc.10.113","","","0.71073","MoKα","","0.0292","0.0271","","","0.0641","0.0655","","","","","","1.061","","","","has coordinates","178474","2020-10-21","18:00:00",""
"4029597","7.6353","0.0011","8.0212","0.0017","12.559","0.003","88.846","0.019","76.201","0.017","66.218","0.017","681","0.3","120","","120","","","","","","","","","5","P -1","-P 1","2","","Diethyl 2-fluoro-2-(2-nitrophenyl)-malonate","","- C13 H14 F N O6 -","- C13 H14 F N O6 -","- C26 H28 F2 N2 O12 -","2","1","","Harsanyi, Antal; Sandford, Graham; Yufit, Dmitri S.; Howard, Judith Ak","Syntheses of fluorooxindole and 2-fluoro-2-arylacetic acid derivatives from diethyl 2-fluoromalonate ester.","Beilstein journal of organic chemistry","2014","10","","1213","1219","10.3762/bjoc.10.119","","","0.7107","MoKα","Mo","0.1339","0.0733","","","0.1489","0.1932","","","","","","1.014","","","","has coordinates","178474","2020-10-21","18:00:00",""
"4029598","7.2946","0.0007","16.473","0.002","7.7761","0.0011","90","","90","","90","","934.4","0.2","120","","120","","","","","","","","","5","P n a 21","P 2c -2n","33","","Methyl 2-fluoro-2-(2-nitrophenyl)acetate","","- C9 H8 F N O4 -","- C9 H8 F N O4 -","- C36 H32 F4 N4 O16 -","4","1","","Harsanyi, Antal; Sandford, Graham; Yufit, Dmitri S.; Howard, Judith Ak","Syntheses of fluorooxindole and 2-fluoro-2-arylacetic acid derivatives from diethyl 2-fluoromalonate ester.","Beilstein journal of organic chemistry","2014","10","","1213","1219","10.3762/bjoc.10.119","","","0.7107","MoKα","Mo","0.086","0.0534","","","0.1065","0.1266","","","","","","1.096","","","","has coordinates","178474","2020-10-21","18:00:00",""
"4029599","5.6568","0.0003","15.4823","0.0009","7.1654","0.0004","90","","96.767","0.002","90","","623.18","0.06","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-fluoromethyl-3-nitropyridine","","- C6 H5 F N2 O2 -","- C6 H5 F N2 O2 -","- C24 H20 F4 N8 O8 -","4","1","","Harsanyi, Antal; Sandford, Graham; Yufit, Dmitri S.; Howard, Judith Ak","Syntheses of fluorooxindole and 2-fluoro-2-arylacetic acid derivatives from diethyl 2-fluoromalonate ester.","Beilstein journal of organic chemistry","2014","10","","1213","1219","10.3762/bjoc.10.119","","x-ray","0.71073","MoKα","K-L~3~","0.0587","0.0462","","","0.1217","0.1347","","","","","","1.036","","","","has coordinates","178474","2020-10-21","18:00:00",""
"4029688","10.1476","0.0009","15.7426","0.0014","10.5615","0.0009","90","","115.257","0.002","90","","1525.9","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C38 H27 Au Cl P -","- C38 H27 Au Cl P -","- C76 H54 Au2 Cl2 P2 -","2","1","","Sun, Yin-Wei; Xu, Qin; Shi, Min","Synthesis of axially chiral gold complexes and their applications in asymmetric catalyses.","Beilstein journal of organic chemistry","2013","9","","2224","2232","10.3762/bjoc.9.261","","","0.71073","MoKα","","0.025","0.0231","","","0.0538","0.055","","","","","","1.022","","","","has coordinates","178475","2020-10-21","18:00:00",""
"4029689","9.0411","0.0007","13.4833","0.001","21.9878","0.0016","90","","90","","90","","2680.4","0.3","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C32 H23 Au Cl O P -","- C32 H23 Au Cl O P -","- C128 H92 Au4 Cl4 O4 P4 -","4","1","","Sun, Yin-Wei; Xu, Qin; Shi, Min","Synthesis of axially chiral gold complexes and their applications in asymmetric catalyses.","Beilstein journal of organic chemistry","2013","9","","2224","2232","10.3762/bjoc.9.261","","","0.71073","MoKα","","0.0468","0.0378","","","0.068","0.0707","","","","","","0.982","","","","has coordinates","178475","2020-10-21","18:00:00",""
"4029690","7.6103","0.0005","12.6408","0.0008","34.029","0.002","90","","90","","90","","3273.6","0.4","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H22 Au F6 I N2 -","- C36 H22 Au F6 I N2 -","- C144 H88 Au4 F24 I4 N8 -","4","1","","Sun, Yin-Wei; Xu, Qin; Shi, Min","Synthesis of axially chiral gold complexes and their applications in asymmetric catalyses.","Beilstein journal of organic chemistry","2013","9","","2224","2232","10.3762/bjoc.9.261","","","0.71073","MoKα","","0.0604","0.0482","","","0.1072","0.1131","","","","","","1.041","","","","has coordinates,has disorder","178475","2020-10-21","18:00:00",""
"4029691","9.6909","0.0005","18.5814","0.0009","36.0427","0.0018","90","","90","","90","","6490.2","0.6","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C36 H22 Au F6 I N2 -","- C36 H22 Au F6 I N2 -","- C288 H176 Au8 F48 I8 N16 -","8","2","","Sun, Yin-Wei; Xu, Qin; Shi, Min","Synthesis of axially chiral gold complexes and their applications in asymmetric catalyses.","Beilstein journal of organic chemistry","2013","9","","2224","2232","10.3762/bjoc.9.261","","","0.71073","MoKα","","0.0684","0.0421","","","0.0793","0.0881","","","","","","0.947","","","","has coordinates,has disorder","178475","2020-10-21","18:00:00",""
"4029692","5.8492","0.0016","13.351","0.004","21.102","0.006","90","","91.971","0.005","90","","1646.9","0.8","273","2","273","2","","","","","","","","2","P 1 21/n 1","-P 2yn","14","","","","- C26 H16 -","- C26 H16 -","- C104 H64 -","4","1","","Sun, Yin-Wei; Xu, Qin; Shi, Min","Synthesis of axially chiral gold complexes and their applications in asymmetric catalyses.","Beilstein journal of organic chemistry","2013","9","","2224","2232","10.3762/bjoc.9.261","","","0.71073","MoKα","","0.1055","0.0678","","","0.163","0.1823","","","","","","1.054","","","","has coordinates","178475","2020-10-21","18:00:00",""
"4029693","7.626","0.004","25.042","0.012","8.473","0.004","90","","116.762","0.008","90","","1444.8","1.2","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C15 H21 N O2 -","- C15 H21 N O2 -","- C60 H84 N4 O8 -","4","2","","Lefranc, Julien; Minassi, Alberto; Clayden, Jonathan","Carbolithiation of N-alkenyl ureas and N-alkenyl carbamates.","Beilstein journal of organic chemistry","2013","9","","628","632","10.3762/bjoc.9.70","","","0.71073","MoKα","","0.0567","0.0456","","","0.0991","0.1039","","","","","","1.062","","","","has coordinates","178475","2020-10-21","18:00:00",""
"4029694","18.293","0.002","22.343","0.003","9.9739","0.0013","90","","90","","90","","4076.5","0.9","100","2","100","2","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C21 H27 Cl N2 O2 -","- C21 H27 Cl N2 O2 -","- C168 H216 Cl8 N16 O16 -","8","1","","Lefranc, Julien; Minassi, Alberto; Clayden, Jonathan","Carbolithiation of N-alkenyl ureas and N-alkenyl carbamates.","Beilstein journal of organic chemistry","2013","9","","628","632","10.3762/bjoc.9.70","","","0.71073","MoKα","","0.136","0.0717","","","0.1855","0.2172","","","","","","0.983","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"4029695","4.2681","0.0009","10.435","0.002","24.586","0.005","90","","90.2","0.03","90","","1095","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","3-nitro-1-(4-(trifluoromethoxy)phenyl)-1H-pyrazole","","- C10 H6 F3 N3 O3 -","- C10 H6 F3 N3 O3 -","- C40 H24 F12 N12 O12 -","4","2","","Kurpet, Marta K.; Dąbrowska, Aleksandra; Jarosz, Małgorzata M; Kajewska-Kania, Katarzyna; Kuźnik, Nikodem; Suwiński, Jerzy W","Coupling of C-nitro-NH-azoles with arylboronic acids. A route to N-aryl-C-nitroazoles.","Beilstein journal of organic chemistry","2013","9","","1517","1525","10.3762/bjoc.9.173","","","0.71073","MoKα","","0.0806","0.0455","","","0.1276","0.1494","","","","","","1.008","","","","has coordinates","178475","2020-10-21","18:00:00",""
"4029696","10.9397","0.0002","10.1557","0.0002","12.7466","0.0002","90","","109.839","0.001","90","","1332.1","0.04","193","2","193","2","","","","","","","chemical synthesis","4","P 1 21 1","P 2yb","4","16-(Dimethylaminomethyl)salvinorin A","(2<i>S</i>,4a<i>R</i>,6a<i>R</i>,7<i>R</i>,9<i>S</i>,10a<i>S</i>,10b<i>R</i>)- Methyl 9-Acetoxy-2-[2-(dimethylaminomethyl)-3-furyl]-6a,10b-dimethyl- 4,10-dioxo-2,4a,5,6,7,8,9,10a-octahydro-1<i>H</i>-benzo[<i>f</i>]isochromene- 7-carboxylate","","- C26.5 H36.5 N O8.25 -","- C26.5 H36.5 N O8.25 -","- C53 H73 N2 O16.5 -","2","1","","Munro, Thomas A.; Xu, Wei; Ho, Douglas M.; Liu-Chen, Lee-Yuan; Cohen, Bruce M.","Studies toward bivalent κ opioids derived from salvinorin A: heteromethylation of the furan ring reduces affinity.","Beilstein journal of organic chemistry","2013","9","","2916","2924","10.3762/bjoc.9.328","","","0.71073","MoKα","","0.0727","0.0584","","","0.1661","0.182","","","","","","1.04","","","","has coordinates,has disorder,has Fobs","176467","2020-10-21","18:00:00",""
"4029697","13.426","0.002","10.1901","0.0018","16.699","0.003","90","","106.72","0.005","90","","2188","0.6","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C46 H56 N6 O4 Pd -","- C46 H56 N6 O4 Pd -","- C92 H112 N12 O8 Pd2 -","2","0.5","","Shaik, Jeelani Basha; Ramkumar, Venkatachalam; Varghese, Babu; Sankararaman, Sethuraman","Synthesis and structure of trans-bis(1,4-dimesityl-3-methyl-1,2,3-triazol-5-ylidene)palladium(II) dichloride and diacetate. Suzuki-Miyaura coupling of polybromoarenes with high catalytic turnover efficiencies.","Beilstein journal of organic chemistry","2013","9","","698","704","10.3762/bjoc.9.79","","","0.71073","MoKα","","0.0882","0.0417","","","0.084","0.1014","","","","","","0.999","","","","has coordinates","178475","2020-10-21","18:00:00",""
"4029698","14.7337","0.0004","14.7337","0.0004","43.098","0.003","90","","90","","90","","9355.8","0.7","293","2","293","2","","","","","","","","5","I 41/a c d :2","-I 4bd 2c","142","","","","- C46 H56 Cl2 N8 Pd -","- C46 H50 Cl2 N8 Pd -","- C368 H400 Cl16 N64 Pd8 -","8","0.25","","Shaik, Jeelani Basha; Ramkumar, Venkatachalam; Varghese, Babu; Sankararaman, Sethuraman","Synthesis and structure of trans-bis(1,4-dimesityl-3-methyl-1,2,3-triazol-5-ylidene)palladium(II) dichloride and diacetate. Suzuki-Miyaura coupling of polybromoarenes with high catalytic turnover efficiencies.","Beilstein journal of organic chemistry","2013","9","","698","704","10.3762/bjoc.9.79","","","0.71073","MoKα","","0.0762","0.0599","","","0.1366","0.1459","","","","","","1.329","","","","has coordinates,has disorder","178475","2020-10-21","18:00:00",""
"4029699","10.1246","0.0014","9.0703","0.0011","22.641","0.004","90","","92.224","0.012","90","","2077.6","0.5","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C27 H22 N2 O S -","- C27 H22 N2 O S -","- C108 H88 N8 O4 S4 -","4","1","","Kumar, Sandeep; Pratap, Ramendra; Kumar, Abhinav; Kumar, Brijesh; Tandon, Vishnu K.; Ram, Vishnu Ji","Direct alkenylation of indolin-2-ones by 6-aryl-4-methylthio-2H-pyran-2-one-3-carbonitriles: a novel approach.","Beilstein journal of organic chemistry","2013","9","","809","817","10.3762/bjoc.9.92","","","0.71073","MoKα","","0.1373","0.0994","","","0.246","0.2727","","","","","","1.053","","","","has coordinates","178475","2020-10-21","18:00:00",""
"4029700","19.5001","0.0009","8.4923","0.0003","22.8927","0.0008","90","","92.088","0.003","90","","3788.5","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H38 N4 O3 S3 -","- C42 H38 N4 O3 S3 -","- C168 H152 N16 O12 S12 -","4","1","","Kumar, Sandeep; Pratap, Ramendra; Kumar, Abhinav; Kumar, Brijesh; Tandon, Vishnu K.; Ram, Vishnu Ji","Direct alkenylation of indolin-2-ones by 6-aryl-4-methylthio-2H-pyran-2-one-3-carbonitriles: a novel approach.","Beilstein journal of organic chemistry","2013","9","","809","817","10.3762/bjoc.9.92","","","0.71073","MoKα","","0.1048","0.0797","","","0.1919","0.2065","","","","","","1.107","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029701","11.342","0.0005","18.0868","0.0007","7.672","0.0003","90","","95.47","0.001","90","","1566.67","0.11","173","2","173","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C28 H46 Cl2 N6 O2 Pd -","- C28 H46 Cl2 N6 O2 Pd -","- C56 H92 Cl4 N12 O4 Pd2 -","2","0.5","","Grirrane, Abdessamad; Garcia, Hermenegildo; Alvarez, Eleuterio","Isolation and X-ray characterization of palladium-N complexes in the guanylation of aromatic amines. Mechanistic implications.","Beilstein journal of organic chemistry","2013","9","","1455","1462","10.3762/bjoc.9.165","","","0.71073","MoKα","","0.0271","0.0239","","","0.0627","0.0641","","","","","","1.06","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029702","11.2008","0.0003","13.5909","0.0004","11.5265","0.0004","90","","111.563","0.001","90","","1631.86","0.09","173","2","173","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C28 H42 Cl2 N6 O4 Pd -","- C28 H42 Cl2 N6 O4 Pd -","- C56 H84 Cl4 N12 O8 Pd2 -","2","0.5","","Grirrane, Abdessamad; Garcia, Hermenegildo; Alvarez, Eleuterio","Isolation and X-ray characterization of palladium-N complexes in the guanylation of aromatic amines. Mechanistic implications.","Beilstein journal of organic chemistry","2013","9","","1455","1462","10.3762/bjoc.9.165","","","0.71073","MoKα","","0.0307","0.0261","","","0.0796","0.0822","","","","","","1.081","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029703","24.09","0.0011","11.4512","0.0005","20.3122","0.0008","90","","114.671","0.001","90","","5091.8","0.4","173","2","173","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C26 H38 Cl2 F2 I2 N6 Pd -","- C26 H38 Cl2 F2 I2 N6 Pd -","- C156 H228 Cl12 F12 I12 N36 Pd6 -","6","1.5","","Grirrane, Abdessamad; Garcia, Hermenegildo; Alvarez, Eleuterio","Isolation and X-ray characterization of palladium-N complexes in the guanylation of aromatic amines. Mechanistic implications.","Beilstein journal of organic chemistry","2013","9","","1455","1462","10.3762/bjoc.9.165","","","0.71073","MoKα","","0.0675","0.0452","","","0.1072","0.116","","","","","","1.071","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029704","12.9","0.007","13.63","0.007","8.531","0.004","90","","90.176","0.016","90","","1500","1.3","173","2","173","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C14 H23 N3 O -","- C14 H23 N3 O -","- C56 H92 N12 O4 -","4","1","","Grirrane, Abdessamad; Garcia, Hermenegildo; Alvarez, Eleuterio","Isolation and X-ray characterization of palladium-N complexes in the guanylation of aromatic amines. Mechanistic implications.","Beilstein journal of organic chemistry","2013","9","","1455","1462","10.3762/bjoc.9.165","","","0.71073","MoKα","","0.0805","0.0681","","","0.1352","0.187","","","","","","1.015","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029705","9.3945","0.0016","11.3837","0.0019","18.54","0.003","83.241","0.004","79.382","0.004","67.287","0.003","1795.3","0.5","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C41 H46 O S3 -","- C41 H46 O S3 -","- C82 H92 O2 S6 -","2","1","","Zhong, Hao; Shi, Jianwu; Kang, Jianxun; Wang, Shaomin; Liu, Xinming; Wang, Hua","Ring-opening reaction of 2,5-dioctyldithieno[2,3-b:3',2'-d]thiophene in the presence of aryllithium reagents.","Beilstein journal of organic chemistry","2013","9","","767","774","10.3762/bjoc.9.87","","","0.71073","MoKα","","0.2076","0.0805","","","0.1802","0.2037","","","","","","1.063","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029706","25.9277","0.0015","7.9561","0.0006","13.1658","0.0007","90","","120.28","0.006","90","","2345.4","0.3","200","2","200","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C14 H14 N4 -","- C14 H14 N4 -","- C112 H112 N32 -","8","1","","Sell, Hanno; Näther, Christian; Herges, Rainer","Amino-substituted diazocines as pincer-type photochromic switches.","Beilstein journal of organic chemistry","2013","9","","1","7","10.3762/bjoc.9.1","","","0.71073","MoKα","","0.0603","0.041","","","0.0962","0.1039","","","","","","1.038","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029707","5.1513","0.0007","25.835","0.003","6.7094","0.001","90","","99.501","0.017","90","","880.7","0.2","200","2","200","2","","","","","","","","4","C 1 m 1","C -2y","8","","","","- C16 H20 N4 O2 -","- C18 H22 N4 O4 -","- C36 H44 N8 O8 -","2","0.5","","Sell, Hanno; Näther, Christian; Herges, Rainer","Amino-substituted diazocines as pincer-type photochromic switches.","Beilstein journal of organic chemistry","2013","9","","1","7","10.3762/bjoc.9.1","","","0.71073","MoKα","","0.0864","0.0571","","","0.1046","0.1155","","","","","","1.024","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029708","8.604","0.002","29.351","0.008","9.698","0.003","90","","90.108","0.004","90","","2449.1","1.2","153","2","153","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C25 H27 Br N2 O7 -","- C25 H27 Br N2 O7 -","- C100 H108 Br4 N8 O28 -","4","2","","Peng, Jiahuan; Du, Da-Ming","Catalytic asymmetric tandem Friedel-Crafts alkylation/Michael addition reaction for the synthesis of highly functionalized chromans.","Beilstein journal of organic chemistry","2013","9","","1210","1216","10.3762/bjoc.9.137","","","0.71073","MoKα","","0.0657","0.0499","","","0.0988","0.1047","","","","","","1.004","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4029709","6.471","0.005","12.191","0.008","43.2","0.03","90","","90","","90","","3408","4","100","","100","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30 H45 N O4 S Si3 -","- C30 H45 N O4 S Si3 -","- C120 H180 N4 O16 S4 Si12 -","4","1","","Miyazaki, Koichiro; Yamane, Yu; Yo, Ryuichiro; Uno, Hidemitsu; Kamimura, Akio","Preparation of optically active bicyclodihydrosiloles by a radical cascade reaction.","Beilstein journal of organic chemistry","2013","9","","1326","1332","10.3762/bjoc.9.149","","","0.71075","MoKα","","0.0805","0.0678","","","0.131","0.1399","","","","","","1.087","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029710","5.958","0.0011","14.455","0.003","20.381","0.004","90","","92.069","0.002","90","","1754.1","0.6","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","(3SR,4RS)-3-(benzyloxy)-4-(pentafluorosulfanylmethyl)- -1-(4-methoxyphenyl)azetidin-2-one","","- C18 H18 F5 N O3 S -","- C18 H18 F5 N O3 S -","- C72 H72 F20 N4 O12 S4 -","4","1","","Penger, Alexander; von Hahmann, Cortney N.; Filatov, Alexander S.; Welch, John T.","Diastereoselectivity in the Staudinger reaction of pentafluorosulfanylaldimines and ketimines.","Beilstein journal of organic chemistry","2013","9","","2675","2680","10.3762/bjoc.9.303","","","0.71073","Mo-Kα","","0.0352","0.0322","","","0.0867","0.0898","","","","","","1.059","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4029711","6.809","0.007","10.145","0.01","14.616","0.015","93.168","0.013","95.116","0.014","97.126","0.013","995.6","1.7","100","2","100","2","","","","","","","","6","P -1","-P 1","2","","(3SR,4RS)-3-(benzyloxy)-4-((1SR)-pentafluorosulfanyl-propyl)- -1-(4-methoxyphenyl)azetidin-2-one","","- C20 H22 F5 N O3 S -","- C20 H22 F5 N O3 S -","- C40 H44 F10 N2 O6 S2 -","2","1","","Penger, Alexander; von Hahmann, Cortney N.; Filatov, Alexander S.; Welch, John T.","Diastereoselectivity in the Staudinger reaction of pentafluorosulfanylaldimines and ketimines.","Beilstein journal of organic chemistry","2013","9","","2675","2680","10.3762/bjoc.9.303","","","0.71073","Mo-Kα","","0.2002","0.1262","","","0.2922","0.3241","","","","","","1.051","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4029712","15.0119","0.0006","3.99067","0.00018","22.8802","0.0009","90","","93.428","0.004","90","","1368.24","0.1","150","","150","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H12 Br2 N2 O3 -","- C13 H12 Br2 N2 O3 -","- C52 H48 Br8 N8 O12 -","4","1","","Gonsior, Nina; Mohr, Fabian; Ritter, Helmut","Synthesis of mesomeric betaine compounds with imidazolium-enolate structure.","Beilstein journal of organic chemistry","2012","8","","390","397","10.3762/bjoc.8.42","","","1.5418","CuKα","","0.0374","0.0317","","","0.0895","0.0921","","","","","","1.038","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029713","22.587","0.003","5.7481","0.0008","16.118","0.002","90","","90","","90","","2092.6","0.5","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C25 H26 N2 O2 -","- C25 H26 N2 O2 -","- C100 H104 N8 O8 -","4","1","","Sun, Jing; Gao, Hong; Wu, Qun; Yan, Chao-Guo","Facile synthesis of functionalized tetrahydroquinolines via domino Povarov reactions of arylamines, methyl propiolate and aromatic aldehydes.","Beilstein journal of organic chemistry","2012","8","","1839","1843","10.3762/bjoc.8.211","","","0.71073","MoKα","","0.045","0.0355","","","0.0792","0.085","","","","","","1.038","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4029714","11.7117","0.0002","11.9571","0.0002","32.2561","0.0006","90","","92.6441","0.0014","90","","4512.27","0.14","100","","100","","","","","","","","synthesized","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H26 Fe N6 -","- C26 H26 Fe N6 -","- C208 H208 Fe8 N48 -","8","2","","White, Nicholas G.; Beer, Paul D.","A ferrocene redox-active triazolium macrocycle that binds and senses chloride.","Beilstein journal of organic chemistry","2012","8","","246","252","10.3762/bjoc.8.25","","","0.6889","Synchrotron","","0.0673","0.0656","","0.1525","0.1523","0.1525","","","","","","1.0444","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4029715","21.1393","0.0008","11.1627","0.0002","9.8316","0.0002","90","","101.439","0.003","90","","2273.9","0.11","120","","120","","","","","","","","synthesised","4","P 1 21/c 1","-P 2ybc","14","","","","- C52 H52 Fe2 N12 -","- C52 H52 Fe2 N12 -","- C104 H104 Fe4 N24 -","2","0.5","","White, Nicholas G.; Beer, Paul D.","A ferrocene redox-active triazolium macrocycle that binds and senses chloride.","Beilstein journal of organic chemistry","2012","8","","246","252","10.3762/bjoc.8.25","","","0.6889","Synchrotron","","0.0645","0.0495","","0.098","0.0914","0.098","","","","","","0.9278","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029716","10.5893","0.0006","19.1221","0.0011","12.1578","0.0007","90","","100.076","0.002","90","","2423.9","0.2","296","2","296","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C27 H21 Au I N3 O -","- C27 H21 Au I N3 O -","- C108 H84 Au4 I4 N12 O4 -","4","2","","Wang, Feijun; Li, Shengke; Qu, Mingliang; Zhao, Mei-Xin; Liu, Lian-Jun; Shi, Min","Synthesis of axially chiral oxazoline-carbene ligands with an N-naphthyl framework and a study of their coordination with AuCl·SMe(2).","Beilstein journal of organic chemistry","2012","8","","726","731","10.3762/bjoc.8.81","","","0.71073","MoKα","","0.0238","0.0228","","","0.0576","0.0581","","","","","","1.03","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029717","10.4511","0.0007","9.1426","0.0006","16.1139","0.0011","90","","105.858","0.001","90","","1481.09","0.17","123","2","123","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C31 H36 Cl N3 O2 S -","- C31 H36 Cl N3 O2 S -","- C62 H72 Cl2 N6 O4 S2 -","2","1","","Callebaut, Gert; Mangelinckx, Sven; Van der Veken, Pieter; Törnroos, Karl W; Augustyns, Koen; De Kimpe, Norbert","Asymmetric synthesis of γ-chloro-α,β-diamino- and β,γ-aziridino-α-aminoacylpyrrolidines and -piperidines via stereoselective Mannich-type additions of N-(diphenylmethylene)glycinamides across α-chloro-N-sulfinylimines.","Beilstein journal of organic chemistry","2012","8","","2124","2131","10.3762/bjoc.8.239","","","0.71073","MoKα","","0.0603","0.0595","","","0.1511","0.1523","","","","","","1.083","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029718","9.7263","0.0006","12.2692","0.0007","17.1677","0.0012","90","","90","","90","","2048.7","0.2","173","","173","","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C23 H23 Cl Fe N2 O2 -","- C23 H23 Cl Fe N2 O2 -","- C92 H92 Cl4 Fe4 N8 O8 -","4","1","","Takebayashi, Satoshi; Shizuno, Tsubasa; Otani, Takashi; Shibata, Takanori","Rh(III)-catalyzed directed C-H bond amidation of ferrocenes with isocyanates.","Beilstein journal of organic chemistry","2012","8","","1844","1848","10.3762/bjoc.8.212","","","0.71075","MoKα","","","0.0304","","","","0.0753","","","","","","1.027","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029719","9.528","0.0006","9.6271","0.0006","16.3779","0.001","90","","90","","90","","1502.3","0.16","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H14 Br N O3 -","- C16 H14 Br N O3 -","- C64 H56 Br4 N4 O12 -","4","1","","Deng, Hong-Ping; Wang, De; Wei, Yin; Shi, Min","Chiral multifunctional thiourea-phosphine catalyzed asymmetric [3 + 2] annulation of Morita-Baylis-Hillman carbonates with maleimides.","Beilstein journal of organic chemistry","2012","8","","1098","1104","10.3762/bjoc.8.121","","","0.71073","MoKα","","0.0577","0.0384","","","0.09","0.0995","","","","","","1.024","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029720","13.8017","0.0007","17.0279","0.0009","18.9988","0.0014","89.971","0.007","80.984","0.007","70.15","0.008","4141.1","0.5","93","","93","","","","","","","","","5","P -1","-P 1","2","","","","- C89.5 H89 Cl2 N2 Pd -","- C89.5 H89 Cl2 N2 Pd -","- C179 H178 Cl4 N4 Pd2 -","2","1","","Martin, Anthony R.; Chartoire, Anthony; Slawin, Alexandra M. Z.; Nolan, Steven P.","Extending the utility of [Pd(NHC)(cinnamyl)Cl] precatalysts: Direct arylation of heterocycles.","Beilstein journal of organic chemistry","2012","8","","1637","1643","10.3762/bjoc.8.187","","","0.71075","MoKα","","","0.0843","","","","0.2577","","","","","","1.043","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4029721","13.7345","0.0013","12.6611","0.0009","25.128","0.002","90","","93.942","0.008","90","","4359.3","0.6","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C56 H21 N13 -","- C56 H21 N13 -","- C224 H84 N52 -","4","1","","Avellaneda, Antonio; Hollis, Courtney A.; He, Xin; Sumby, Christopher J.","Fluorescent hexaaryl- and hexa-heteroaryl[3]radialenes: Synthesis, structures, and properties.","Beilstein journal of organic chemistry","2012","8","","71","80","10.3762/bjoc.8.7","","","0.7107","MoKα","","0.1324","0.0682","","","0.1296","0.1608","","","","","","1.025","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029722","17.373","0.011","17.241","0.011","24.421","0.016","90","","91.219","0.009","90","","7313","8","296","2","296","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C23 H19 N O -","- C23 H19 N O -","- C368 H304 N16 O16 -","16","4","","Lu, Nianhong; Wang, Lihong; Li, Zhanshan; Zhang, Wei","A concise synthesis of 3-(1-alkenyl)isoindolin-1-ones and 5-(1-alkenyl)pyrrol-2-ones by the intermolecular coupling reactions of N-acyliminium ions with unactivated olefins.","Beilstein journal of organic chemistry","2012","8","","192","200","10.3762/bjoc.8.21","","","0.71073","MoKα","","0.1786","0.0696","","","0.1427","0.1999","","","","","","0.959","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029723","7.8821","0.0016","18.975","0.004","15.737","0.003","90","","92.84","0.03","90","","2350.8","0.8","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H38 Li N O4 -","- C22 H38 Li N O4 -","- C88 H152 Li4 N4 O16 -","4","1","","Wheatley, Andrew E. H.; Clayden, Jonathan; Hillier, Ian H.; Campbell Smith, Alison; Vincent, Mark A.; Taylor, Laurence J.; Haywood, Joanna","On the control of secondary carbanion structure utilising ligand effects during directed metallation.","Beilstein journal of organic chemistry","2012","8","","50","60","10.3762/bjoc.8.5","","","0.71073","MoKα","","0.1263","0.0938","","","0.2489","0.2729","","","","","","1.04","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029724","9.6194","0.0002","29.1721","0.0008","10.0296","0.0003","90","","102.643","0.002","90","","2746.24","0.13","180","2","180","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C25 H47 Li N4 O -","- C25 H47 Li N4 O -","- C100 H188 Li4 N16 O4 -","4","1","","Wheatley, Andrew E. H.; Clayden, Jonathan; Hillier, Ian H.; Campbell Smith, Alison; Vincent, Mark A.; Taylor, Laurence J.; Haywood, Joanna","On the control of secondary carbanion structure utilising ligand effects during directed metallation.","Beilstein journal of organic chemistry","2012","8","","50","60","10.3762/bjoc.8.5","","","0.7107","MoKα","","0.1008","0.0493","","","0.1121","0.1261","","","","","","0.976","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029725","11.405","0.002","14.943","0.003","10.8676","0.0018","90","","90","","90","","1852.1","0.6","100","2","100","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C19 H21 N3 O6 -","- C19 H21 N3 O6 -","- C76 H84 N12 O24 -","4","1","","Jakubec, Pavol; Cockfield, Dane M.; Helliwell, Madeleine; Raftery, James; Dixon, Darren J.","Stereoselective, nitro-Mannich/lactamisation cascades for the direct synthesis of heavily decorated 5-nitropiperidin-2-ones and related heterocycles.","Beilstein journal of organic chemistry","2012","8","","567","578","10.3762/bjoc.8.64","","","0.71073","MoKα","","0.028","0.0271","","","0.0667","0.0672","","","","","","1.091","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4029726","6.4732","0.0005","10.4674","0.0007","14.5108","0.001","90","","95.05","0.001","90","","979.4","0.12","100","2","100","2","","","","","","","","4","P 1 n 1","P -2yac","7","","","","- C23 H23 N3 O4 -","- C23 H23 N3 O4 -","- C46 H46 N6 O8 -","2","1","","Jakubec, Pavol; Cockfield, Dane M.; Helliwell, Madeleine; Raftery, James; Dixon, Darren J.","Stereoselective, nitro-Mannich/lactamisation cascades for the direct synthesis of heavily decorated 5-nitropiperidin-2-ones and related heterocycles.","Beilstein journal of organic chemistry","2012","8","","567","578","10.3762/bjoc.8.64","","","0.71073","MoKα","","0.0276","0.0273","","","0.0713","0.0715","","","","","","1.088","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4029727","15.0761","0.0019","10.72","0.0013","23.726","0.003","90","","90","","90","","3834.5","0.8","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C23 H23 N3 O4 -","- C23 H23 N3 O4 -","- C184 H184 N24 O32 -","8","1","","Jakubec, Pavol; Cockfield, Dane M.; Helliwell, Madeleine; Raftery, James; Dixon, Darren J.","Stereoselective, nitro-Mannich/lactamisation cascades for the direct synthesis of heavily decorated 5-nitropiperidin-2-ones and related heterocycles.","Beilstein journal of organic chemistry","2012","8","","567","578","10.3762/bjoc.8.64","","","0.71073","MoKα","","0.0718","0.0416","","","0.093","0.1026","","","","","","0.891","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4029728","6.6527","0.0001","14.3997","0.0002","14.2861","0.0002","90","","91.7612","0.0006","90","","1367.92","0.03","150","","150","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H16 N2 O6 -","- C13 H16 N2 O6 -","- C52 H64 N8 O24 -","4","1","","Jakubec, Pavol; Cockfield, Dane M.; Helliwell, Madeleine; Raftery, James; Dixon, Darren J.","Stereoselective, nitro-Mannich/lactamisation cascades for the direct synthesis of heavily decorated 5-nitropiperidin-2-ones and related heterocycles.","Beilstein journal of organic chemistry","2012","8","","567","578","10.3762/bjoc.8.64","","","0.71073","MoKα","","0.0502","0.0356","","0.0865","0.0814","0.0865","","","","","","0.9401","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4029729","20.7471","0.0006","7.3739","0.0002","12.0188","0.0003","90","","90.9587","0.0014","90","","1838.46","0.09","150","","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H26 N2 O -","- C23 H26 N2 O -","- C92 H104 N8 O4 -","4","1","","Jakubec, Pavol; Cockfield, Dane M.; Helliwell, Madeleine; Raftery, James; Dixon, Darren J.","Stereoselective, nitro-Mannich/lactamisation cascades for the direct synthesis of heavily decorated 5-nitropiperidin-2-ones and related heterocycles.","Beilstein journal of organic chemistry","2012","8","","567","578","10.3762/bjoc.8.64","","","0.71073","MoKα","","0.0891","0.0501","","0.1558","0.1161","0.1558","","","","","","0.9724","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4029730","27.975","0.005","27.975","0.005","48.786","0.017","90","","90","","90","","38180","16","150","2","150","","","","","","","","","7","I 41/a :2","-I 4ad","88","","","","- C66 H70 F12 N8 O20 Ru4 S4 -","- C66 H70 F12 N8 O20 Ru4 S4 -","- C1056 H1120 F192 N128 O320 Ru64 S64 -","16","1","","Shanmugaraju, Sankarasekaran; Samanta, Dipak; Mukherjee, Partha Sarathi","Self-assembly of Ru(4) and Ru(8) assemblies by coordination using organometallic Ru(II)(2) precursors: Synthesis, characterization and properties.","Beilstein journal of organic chemistry","2012","8","","313","322","10.3762/bjoc.8.34","","","0.71073","MoKα","","0.3104","0.1152","","","0.2819","0.4337","","","","","","1.04","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029731","13.8087","0.0013","18.1428","0.0014","15.5037","0.0013","90","","103.271","0.003","90","","3780.4","0.6","100","2","100","2","","","","","","","","9","P 1 21/c 1","-P 2ybc","14","","","","- C64 H100 Ag2 F6 Ir2 N2 O8 P4 S2 -","- C64 H100 Ag2 F6 Ir2 N2 O8 P4 S2 -","- C128 H200 Ag4 F12 Ir4 N4 O16 P8 S4 -","2","0.5","","Whited, Matthew T.","Metal-ligand multiple bonds as frustrated Lewis pairs for C-H functionalization.","Beilstein journal of organic chemistry","2012","8","","1554","1563","10.3762/bjoc.8.177","","","0.71073","MoKα","","0.0655","0.0324","","","0.0457","0.0478","","","","","","1.977","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4029732","6.8215","0.0001","13.434","0.0003","17.9267","0.0004","90","","90","","90","","1642.8","0.06","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H22 O2 Si -","- C18 H22 O2 Si -","- C72 H88 O8 Si4 -","4","1","","Cho, Inhee; Meimetis, Labros; Belding, Lee; Katz, Michael J.; Dudding, Travis; Britton, Robert","Directed ortho,ortho'-dimetalation of hydrobenzoin: Rapid access to hydrobenzoin derivatives useful for asymmetric synthesis.","Beilstein journal of organic chemistry","2011","7","","1315","1322","10.3762/bjoc.7.154","","","0.71073","MoKα","","0.0427","0.0291","","0.0573","0.0342","0.0342","","","","","","0.7515","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4029733","8.855","0.004","28.605","0.014","11.19","0.005","90","","96.194","0.007","90","","2818","2","293","","293","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H22 O2 Si2 -","- C18 H22 O2 Si2 -","- C108 H132 O12 Si12 -","6","3","","Cho, Inhee; Meimetis, Labros; Belding, Lee; Katz, Michael J.; Dudding, Travis; Britton, Robert","Directed ortho,ortho'-dimetalation of hydrobenzoin: Rapid access to hydrobenzoin derivatives useful for asymmetric synthesis.","Beilstein journal of organic chemistry","2011","7","","1315","1322","10.3762/bjoc.7.154","","","0.71073","MoKα","","0.17","0.0346","","0.0663","0.0267","0.0267","","","","","","0.8073","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029734","19.6672","0.0013","16.8432","0.0012","10.2146","0.0006","90","","101.481","0.004","90","","3316","0.4","100","2","100","2","","","","","","","synthesis as described","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H47 Cl5 P Ru2 -","- C28 H47 Cl5 P Ru2 -","- C112 H188 Cl20 P4 Ru8 -","4","1","","Borguet, Yannick; Sauvage, Xavier; Zaragoza, Guillermo; Demonceau, Albert; Delaude, Lionel","Tandem catalysis of ring-closing metathesis/atom transfer radical reactions with homobimetallic ruthenium-arene complexes.","Beilstein journal of organic chemistry","2010","6","","1167","1173","10.3762/bjoc.6.133","","x-ray","0.7107","MoKα","","0.0536","0.0327","","","0.056","0.0621","","","","","","1.049","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029735","11.866","0.0003","13.8803","0.0004","20.4843","0.0005","78.2372","0.0016","78.1856","0.0017","84.2881","0.0008","3227.13","0.15","110","2","110","2","","","","","","","","5","P -1","-P 1","2","","","","- C54 H36 N8 O13 Zn -","- C54 H36 N8 O13 Zn -","- C108 H72 N16 O26 Zn2 -","2","1","","Lipstman, Sophia; Goldberg, Israel","Versatile supramolecular reactivity of zinc-tetra(4-pyridyl)porphyrin in crystalline solids: Polymeric grids with zinc dichloride and hydrogen-bonded networks with mellitic acid.","Beilstein journal of organic chemistry","2009","5","","77","","10.3762/bjoc.5.77","","","0.71073","MoKα","","0.0924","0.0598","","","0.1553","0.1672","","","","","","0.96","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029736","5.7147","0.0001","13.9252","0.0002","22.2681","0.0003","90","","93.0935","0.0007","90","","1769.48","0.05","90","0.2","90","0.2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H23 N4 O0.5 -","- C20 H23 N4 O0.5 -","- C80 H92 N16 O2 -","4","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.0849","0.0617","","","0.1722","0.1904","","","","","","1.083","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4029737","5.3485","0.0005","7.4424","0.0007","33.559","0.003","90","","90","","90","","1335.8","0.2","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H11 N O2 S -","- C16 H11 N O2 S -","- C64 H44 N4 O8 S4 -","4","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.0961","0.0461","","","0.1007","0.1352","","","","","","1.038","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029738","8.806","0.0009","17.5089","0.0012","11.1635","0.0011","90","","111.693","0.012","90","","1599.3","0.3","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H52 N6 Na2 -","- C28 H52 N6 Na2 -","- C56 H104 N12 Na4 -","2","0.5","","Armstrong, David R.; Balloch, Liam; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.; O'Hara, Charles T; Robertson, Stuart D.","Meta-metallation of N,N-dimethylaniline: Contrasting direct sodium-mediated zincation with indirect sodiation-dialkylzinc co-complexation.","Beilstein journal of organic chemistry","2011","7","","1234","1248","10.3762/bjoc.7.144","","","0.71073","MoKα","","0.085","0.0471","","","0.1052","0.1133","","","","","","0.905","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029739","9.3229","0.0002","20.0052","0.0004","26.2813","0.0006","86.732","0.002","82.721","0.002","87.247","0.002","4850.1","0.18","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C82 H164 N13 Na3 Zn4 -","- C82 H164 N13 Na3 Zn4 -","- C164 H328 N26 Na6 Zn8 -","2","1","","Armstrong, David R.; Balloch, Liam; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.; O'Hara, Charles T; Robertson, Stuart D.","Meta-metallation of N,N-dimethylaniline: Contrasting direct sodium-mediated zincation with indirect sodiation-dialkylzinc co-complexation.","Beilstein journal of organic chemistry","2011","7","","1234","1248","10.3762/bjoc.7.144","","","0.71073","MoKα","","0.0996","0.0413","","","0.0618","0.068","","","","","","0.809","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029740","16.1371","0.0005","17.2078","0.0005","21.6306","0.0005","90","","90","","90","","6006.5","0.3","123","2","123","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C27 H53 N4 Na Zn -","- C27 H53 N4 Na Zn -","- C216 H424 N32 Na8 Zn8 -","8","1","","Armstrong, David R.; Balloch, Liam; Hevia, Eva; Kennedy, Alan R.; Mulvey, Robert E.; O'Hara, Charles T; Robertson, Stuart D.","Meta-metallation of N,N-dimethylaniline: Contrasting direct sodium-mediated zincation with indirect sodiation-dialkylzinc co-complexation.","Beilstein journal of organic chemistry","2011","7","","1234","1248","10.3762/bjoc.7.144","","","0.71073","MoKα","","0.0787","0.0371","","","0.0806","0.0853","","","","","","0.881","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029741","11.0884","0.001","7.3529","0.0009","10.3794","0.0014","90","","105.071","0.01","90","","817.14","0.17","100.15","","100","","","","","","","","Synthesized by Author","6","P 1 21/c 1","-P 2ybc","14","","Sodium Morpholinomethanesulfonate","","- C5 H10 N Na O4 S -","- C5 H10 N Na O4 S -","- C20 H40 N4 Na4 O16 S4 -","4","1","","Long, Robert D.; Hilliard, Newton P.; Chhatre, Suneel A.; Timofeeva, Tatiana V.; Yakovenko, Andrey A.; Dei, Daniel K.; Mensah, Enoch A.","Comparison of zwitterionic N-alkylaminomethanesulfonic acids to related compounds in the Good buffer series.","Beilstein journal of organic chemistry","2010","6","","31","","10.3762/bjoc.6.31","","","1.5418","CuKα","","0.0318","0.0266","","0.0344","0.0303","0.0303","","","","","","1.0282","","","","has coordinates","176432","2020-10-21","18:00:00",""
"4029742","19.1157","0.0002","12.9275","0.0002","21.8495","0.0002","90","","103.396","0.0006","90","","5252.51","0.11","110","2","110","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C46 H30 Cl14 N8 Zn2 -","- C46 H30 Cl14 N8 Zn2 -","- C184 H120 Cl56 N32 Zn8 -","4","1","","Lipstman, Sophia; Goldberg, Israel","Versatile supramolecular reactivity of zinc-tetra(4-pyridyl)porphyrin in crystalline solids: Polymeric grids with zinc dichloride and hydrogen-bonded networks with mellitic acid.","Beilstein journal of organic chemistry","2009","5","","77","","10.3762/bjoc.5.77","","","0.71073","MoKα","","0.0988","0.0646","","","0.1795","0.1997","","","","","","1.058","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029743","15.6729","0.0002","14.6136","0.0002","21.7183","0.0003","90","","103.625","0.0005","90","","4834.32","0.11","90","0.2","90","0.2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C10 H18 N4 -","- C10 H18 N4 -","- C160 H288 N64 -","16","4","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.1065","0.0499","","","0.1077","0.1272","","","","","","0.988","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029744","4.3029","0.0008","12.249","0.002","23.927","0.006","90","","90","","90","","1261.1","0.4","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H12 N2 O2 -","- C16 H12 N2 O2 -","- C64 H48 N8 O8 -","4","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.1538","0.0681","","","0.1446","0.1795","","","","","","0.885","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029745","7.9547","0.0004","11.9678","0.0004","15.5015","0.0006","90","0","101.144","0.0021","90","0","1447.92","0.1","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 Br4 O2 -","- C14 H10 Br4 O2 -","- C56 H40 Br16 O8 -","4","1","","Berkil Akar, Kiymet; Cakmak, Osman; Büyükgüngör, Orhan; Sahin, Ertan","Functionalization of anthracene: A selective route to brominated 1,4-anthraquinones.","Beilstein journal of organic chemistry","2011","7","","1036","1045","10.3762/bjoc.7.118","","x-ray","0.71073","MoKα","","0.1022","0.0686","","","0.0876","0.0952","","","","","","1.217","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029746","5.7353","0.0005","8.6076","0.0007","10.9633","0.0009","75.05","0.001","74.959","0.001","79.491","0.001","501.11","0.07","298","2","298","2","","","","","","","","5","P -1","-P 1","2","HEPMS","N-(2-Hydroxyethyl)piperazine-N'-methanesulfonic acid","","- C7 H16 N2 O4 S -","- C7 H16 N2 O4 S -","- C14 H32 N4 O8 S2 -","2","1","","Long, Robert D.; Hilliard, Newton P.; Chhatre, Suneel A.; Timofeeva, Tatiana V.; Yakovenko, Andrey A.; Dei, Daniel K.; Mensah, Enoch A.","Comparison of zwitterionic N-alkylaminomethanesulfonic acids to related compounds in the Good buffer series.","Beilstein journal of organic chemistry","2010","6","","31","","10.3762/bjoc.6.31","","","0.71073","MoKα","","0.038","0.0325","","","0.078","0.0815","","","","","","1.002","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029747","10.1882","0.0003","10.616","0.0004","16.3593","0.0005","90","","90","","90","","1769.39","0.1","123","","123","","","","","","","","see text","4","P n a 21","P 2c -2n","33","","","","- C15 H27 N O5 -","- C15 H27 N O5 -","- C60 H108 N4 O20 -","4","1","","Grauer, Andreas A.; König, Burkhard","Synthesis of new Calpha-tetrasubstituted alpha-amino acids.","Beilstein journal of organic chemistry","2009","5","","5","","10.3762/bjoc.5.5","","x-ray","1.54184","CuKα","","0.0719","0.0623","","","0.1808","0.1896","","","","","","1.079","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029748","5.7467","0.0001","13.8294","0.0003","22.1701","0.0005","90","","93.377","0.001","90","","1758.87","0.06","90","0.2","90","0.2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21.5 H22 N4 -","- C21.5 H22 N4 -","- C86 H88 N16 -","4","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.1201","0.0694","","","0.1947","0.2269","","","","","","1.044","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4029749","3.8313","0.0005","12.5135","0.0018","14.2512","0.0019","112.212","0.009","93.326","0.011","93.864","0.011","628.52","0.15","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H11 N O3 -","- C16 H11 N O3 -","- C32 H22 N2 O6 -","2","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.1295","0.0669","","","0.1804","0.212","","","","","","1.047","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029750","12.8322","0.0006","13.232","0.0007","11.1619","0.0005","90","","115.092","0.003","90","","1716.38","0.15","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H14 Br4 O2 -","- C16 H14 Br4 O2 -","- C64 H56 Br16 O8 -","4","1","","Berkil Akar, Kiymet; Cakmak, Osman; Büyükgüngör, Orhan; Sahin, Ertan","Functionalization of anthracene: A selective route to brominated 1,4-anthraquinones.","Beilstein journal of organic chemistry","2011","7","","1036","1045","10.3762/bjoc.7.118","","","0.71073","MoKα","","0.0776","0.0484","","","0.0843","0.0931","","","","","","1.069","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029751","7.5928","0.0008","20.9792","0.0011","15.9792","0.0013","90","","94.236","0.008","90","","2538.4","0.4","123","2","123","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10.5 H3 Br2 Cl O2 S2 -","- C10.5 H3 Br2 Cl O2 S2 -","- C84 H24 Br16 Cl8 O16 S16 -","8","2","","Meyer, Annemarie; Sigmund, Eva; Luppertz, Friedhelm; Schnakenburg, Gregor; Gadaczek, Immanuel; Bredow, Thomas; Jester, Stefan-S; Höger, Sigurd","Syntheses and properties of thienyl-substituted dithienophenazines.","Beilstein journal of organic chemistry","2010","6","","1180","1187","10.3762/bjoc.6.135","","","0.71073","MoKα","","0.1545","0.0672","","","0.1211","0.1478","","","","","","0.895","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029752","8.9233","0.0004","14.8008","0.0008","6.6258","0.0002","90","","102.935","0.003","90","","852.88","0.07","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H4 O2 S2 -","- C10 H4 O2 S2 -","- C40 H16 O8 S8 -","4","1","","Meyer, Annemarie; Sigmund, Eva; Luppertz, Friedhelm; Schnakenburg, Gregor; Gadaczek, Immanuel; Bredow, Thomas; Jester, Stefan-S; Höger, Sigurd","Syntheses and properties of thienyl-substituted dithienophenazines.","Beilstein journal of organic chemistry","2010","6","","1180","1187","10.3762/bjoc.6.135","","","0.71073","MoKα","","0.0376","0.0272","","","0.0699","0.0736","","","","","","1.044","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029753","3.9971","0.0016","10.334","0.004","31.473","0.013","90","","90","","90","","1300","0.9","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C18 H10 S2 -","- C18 H10 S2 -","- C72 H40 S8 -","4","1","","Wang, Zhihua; Zhu, Sheng; Shi, Jianwu; Wang, Hua","The efficient synthesis of dibenzo[d,d']benzo[1,2-b:4,3-b']dithiophene and cyclopenta[1,2-b:4,3-b']bis(benzo[d]thiophen)-6-one.","Beilstein journal of organic chemistry","2009","5","","55","","10.3762/bjoc.5.55","","","0.71073","MoKα","","0.0395","0.0335","","","0.076","0.0846","","","","","","1.042","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029754","11.938","0.0002","16.4303","0.0003","25.0589","0.0005","90","","95.0346","0.0007","90","","4896.21","0.16","90","0.2","90","0.2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C30 H26 N4 -","- C30 H26 N4 -","- C240 H208 N32 -","8","2","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.1016","0.0458","","","0.1006","0.1201","","","","","","0.97","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029755","5.4646","0.0011","11.742","0.002","13.204","0.002","69.478","0.011","85.113","0.011","85.709","0.012","789.7","0.2","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H24 N2 O -","- C18 H24 N2 O -","- C36 H48 N4 O2 -","2","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.176","0.0785","","","0.2076","0.2846","","","","","","0.892","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029756","9.2786","0.0007","25.5371","0.0019","10.1633","0.0007","90","","104.948","0.001","90","","2326.7","0.3","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C24 H23 Au I N3 O3 -","- C24 H23 Au I N3 O3 -","- C96 H92 Au4 I4 N12 O12 -","4","2","","Liu, Lian-Jun; Wang, Feijun; Wang, Wenfeng; Zhao, Mei-Xin; Shi, Min","Synthesis of chiral mono(N-heterocyclic carbene) palladium and gold complexes with a 1,1'-biphenyl scaffold and their applications in catalysis.","Beilstein journal of organic chemistry","2011","7","","555","564","10.3762/bjoc.7.64","","","0.71073","MoKα","","0.0523","0.0478","","","0.1273","0.1296","","","","","","1","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029757","9.1096","0.0003","13.0878","0.0005","14.0139","0.0006","93.832","0.002","101.26","0.002","104.981","0.002","1570.77","0.11","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C30 H32 N2 O6 S4 -","- C30 H32 N2 O6 S4 -","- C60 H64 N4 O12 S8 -","2","1","","Wang, Hong-Bo; Wisner, James A.; Jennings, Michael C.","Anion receptors containing thiazine-1,1-dioxide heterocycles as hydrogen bond donors.","Beilstein journal of organic chemistry","2010","6","","50","","10.3762/bjoc.6.50","","","0.71073","MoKα","","0.0703","0.0466","","","0.1206","0.1317","","","","","","1.082","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029758","7.3616","0.0001","32.8092","0.0004","12.0824","0.0002","90","","102.896","0.001","90","","2844.63","0.07","123","","123","","","","","","","","see text","4","P 1 21/c 1","-P 2ybc","14","","","","- C29 H35 N5 O7 -","- C29 H35 N5 O7 -","- C116 H140 N20 O28 -","4","1","","Schmaderer, Harald; Bhuyan, Mouchumi; König, Burkhard","Synthesis of rigidified flavin-guanidinium ion conjugates and investigation of their photocatalytic properties.","Beilstein journal of organic chemistry","2009","5","","26","","10.3762/bjoc.5.26","","x-ray","1.54184","CuKα","","0.0854","0.0721","","","0.1922","0.2017","","","","","","1.091","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029759","11.7463","0.0003","9.5792","0.0002","17.6727","0.0004","90","","99.284","0.002","90","","1962.49","0.08","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C24 H14 N2 O3 -","- C24 H20 N2 O3 -","- C96 H80 N8 O12 -","4","1","","Singh, Marjit W.; Karmakar, Anirban; Barooah, Nilotpal; Baruah, Jubaraj B.","Variations in product in reactions of naphthoquinone with primary amines.","Beilstein journal of organic chemistry","2007","3","1","10","","10.1186/1860-5397-3-10","","","0.71073","MoKα","","0.0833","0.0477","","","0.1359","0.163","","","","","","0.976","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029760","9.8872","0.0008","16.8643","0.0014","16.8744","0.0015","90","","100.713","0.002","90","","2764.6","0.4","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H28 I N3 O3 Pd -","- C27 H28 I N3 O3 Pd -","- C108 H112 I4 N12 O12 Pd4 -","4","1","","Liu, Lian-Jun; Wang, Feijun; Wang, Wenfeng; Zhao, Mei-Xin; Shi, Min","Synthesis of chiral mono(N-heterocyclic carbene) palladium and gold complexes with a 1,1'-biphenyl scaffold and their applications in catalysis.","Beilstein journal of organic chemistry","2011","7","","555","564","10.3762/bjoc.7.64","","","0.71073","MoKα","","0.078","0.0491","","","0.1007","0.1109","","","","","","0.936","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029761","10.6274","0.0005","10.8445","0.0007","14.7918","0.0011","86.69","0.003","87.617","0.003","81.397","0.003","1681.81","0.18","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C31 H37 N3 O7 S5 -","- C31 H37 N3 O7 S5 -","- C62 H74 N6 O14 S10 -","2","1","","Wang, Hong-Bo; Wisner, James A.; Jennings, Michael C.","Anion receptors containing thiazine-1,1-dioxide heterocycles as hydrogen bond donors.","Beilstein journal of organic chemistry","2010","6","","50","","10.3762/bjoc.6.50","","","0.71073","MoKα","","0.0787","0.048","","","0.1068","0.1203","","","","","","1.037","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029762","10.6278","0.0004","11.8039","0.0006","12.8185","0.0005","84.158","0.004","81.21","0.004","71.668","0.004","1506.06","0.12","123","","123","","","","","","","","see text","5","P -1","-P 1","2","","","","- C29 H37 N5 O7 S -","- C29 H37 N5 O7 S -","- C58 H74 N10 O14 S2 -","2","1","","Schmaderer, Harald; Bhuyan, Mouchumi; König, Burkhard","Synthesis of rigidified flavin-guanidinium ion conjugates and investigation of their photocatalytic properties.","Beilstein journal of organic chemistry","2009","5","","26","","10.3762/bjoc.5.26","","x-ray","1.54184","CuKα","","0.0765","0.0655","","","0.1783","0.1888","","","","","","1.039","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029763","8.5317","0.0002","8.7993","0.0002","11.5447","0.0004","81.8531","0.0012","68.8269","0.0012","61.5111","0.0014","709.83","0.04","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C13 H24 N4 -","- C13 H24 N4 -","- C26 H48 N8 -","2","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.083","0.0497","","","0.1262","0.1443","","","","","","1.046","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029764","10.5103","0.0016","7.5216","0.0012","24.079","0.004","90","","93.496","0.003","90","","1900","0.5","193","2","193","2","","","","","","","Na2CO3/MeOH treatment of salvinorin A from Salvia divinorum leaves","3","P 1 21 1","P 2yb","4","8-epi-salvinorin B","(2S,4aS,6aR,7R,9S,10aS,10bR)-methyl 2-(3-furanyl)-dodecahydro-9-hydroxy-6a,10b-dimethyl-4,10-dioxo- 2H-naphtho[2,1-c]pyran-7-carboxylate","","- C21 H26 O7 -","- C21 H26 O7 -","- C84 H104 O28 -","4","2","","Munro, Thomas A.; Duncan, Katharine K.; Staples, Richard J.; Xu, Wei; Liu-Chen, Lee-Yuan; Béguin, Cécile; Carlezon, Jr, William A; Cohen, Bruce M.","8-epi-Salvinorin B: crystal structure and affinity at the kappa opioid receptor.","Beilstein journal of organic chemistry","2007","3","1","1","","10.1186/1860-5397-3-1","","","0.71073","MoKα","","0.0481","0.0427","","","0.0934","0.0962","","","","","","1.01","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"4029765","22.9943","0.0004","6.7284","0.0001","23.2627","0.0004","90","","112.879","0.001","90","","3315.94","0.1","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C160 H152 N8 O24 -","8","2","","Sow, Boubacar; Bellavance, Gabriel; Barabé, Francis; Barriault, Louis","One-pot Diels-Alder cycloaddition/gold(I)-catalyzed 6-endo-dig cyclization for the synthesis of the complex bicyclo[3.3.1]alkenone framework.","Beilstein journal of organic chemistry","2011","7","","1007","1013","10.3762/bjoc.7.114","","","0.71073","MoKα","","0.0701","0.0423","","","0.0946","0.1064","","","","","","1.014","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029766","10.243","0.004","5.633","0.002","15.676","0.006","90","","94.912","0.005","90","","901.2","0.6","293","2","293","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C14 H16 F12 O4 -","- C14 H16 F12 O4 -","- C28 H32 F24 O8 -","2","0.5","","Petrov, Viacheslav A.; Marshall, Will","Acid catalyzed cyclodimerization of 2,2-bis(trifluoromethyl)-4-alkoxy-oxetanes and -thietanes. Synthesis of 2,2,6,6-tetrakis(trifluoromethyl)-4,8-dialkoxy-1,5-dioxocanes and 3,3,7,7-tetrakis(trifluoromethyl)-9-oxa-2,6-dithia-bicyclo[3.3.1]nonane.","Beilstein journal of organic chemistry","2010","6","","46","","10.3762/bjoc.6.46","","","0.71073","MoKα","","0.0493","0.0349","","","0.0847","0.0927","","","","","","1.043","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029767","5.564","0.002","9.647","0.004","9.926","0.004","100.015","0.006","105.203","0.006","92.977","0.006","503.6","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C16 H20 F12 O4 -","- C16 H20 F12 O4 -","- C16 H20 F12 O4 -","1","0.5","","Petrov, Viacheslav A.; Marshall, Will","Acid catalyzed cyclodimerization of 2,2-bis(trifluoromethyl)-4-alkoxy-oxetanes and -thietanes. Synthesis of 2,2,6,6-tetrakis(trifluoromethyl)-4,8-dialkoxy-1,5-dioxocanes and 3,3,7,7-tetrakis(trifluoromethyl)-9-oxa-2,6-dithia-bicyclo[3.3.1]nonane.","Beilstein journal of organic chemistry","2010","6","","46","","10.3762/bjoc.6.46","","","0.71073","MoKα","","0.1011","0.0501","","","0.1057","0.1263","","","","","","0.965","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029768","10.1499","0.0012","10.1499","0.0012","22.75","0.005","90","","90","","90","","2343.7","0.6","293","2","293","2","","","","","","","","5","P 43 21 2","P 4nw 2abw","96","","","","- C9 H12 F6 N0 O2 -","- C9 H12 F6 O2 -","- C72 H96 F48 O16 -","8","1","","Petrov, Viacheslav A.; Marshall, Will","Acid catalyzed cyclodimerization of 2,2-bis(trifluoromethyl)-4-alkoxy-oxetanes and -thietanes. Synthesis of 2,2,6,6-tetrakis(trifluoromethyl)-4,8-dialkoxy-1,5-dioxocanes and 3,3,7,7-tetrakis(trifluoromethyl)-9-oxa-2,6-dithia-bicyclo[3.3.1]nonane.","Beilstein journal of organic chemistry","2010","6","","46","","10.3762/bjoc.6.46","","","0.71073","MoKα","","0.0303","0.0268","","","0.0665","0.0686","","","","","","1.057","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029769","21.271","0.006","25.685","0.007","10.563","0.003","90","","90","","90","","5771","3","293","2","293","2","","","","","","","","5","C c c a :2","-C 2a 2ac","68","","","","- C10 H6 F12 O S2 -","- C10 H6 F12 O S2 -","- C160 H96 F192 O16 S32 -","16","1","","Petrov, Viacheslav A.; Marshall, Will","Acid catalyzed cyclodimerization of 2,2-bis(trifluoromethyl)-4-alkoxy-oxetanes and -thietanes. Synthesis of 2,2,6,6-tetrakis(trifluoromethyl)-4,8-dialkoxy-1,5-dioxocanes and 3,3,7,7-tetrakis(trifluoromethyl)-9-oxa-2,6-dithia-bicyclo[3.3.1]nonane.","Beilstein journal of organic chemistry","2010","6","","46","","10.3762/bjoc.6.46","","","0.71073","MoKα","","0.0402","0.0308","","","0.0745","0.0825","","","","","","1.044","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029770","12.4965","0.0002","13.0048","0.0002","18.7848","0.0003","90","","106.648","0.0017","90","","2924.84","0.08","123","","123","","","","","","","","see text","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H39 Cl N8 O6 -","- C29 H39 Cl N8 O6 -","- C116 H156 Cl4 N32 O24 -","4","1","","Schmaderer, Harald; Bhuyan, Mouchumi; König, Burkhard","Synthesis of rigidified flavin-guanidinium ion conjugates and investigation of their photocatalytic properties.","Beilstein journal of organic chemistry","2009","5","","26","","10.3762/bjoc.5.26","","x-ray","1.54184","CuKα","","0.0733","0.0586","","","0.1651","0.1742","","","","","","1.038","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029771","9.3287","0.0001","9.479","0.0001","10.4921","0.0002","87.4755","0.0006","70.5173","0.0006","76.4271","0.0006","849.64","0.02","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H22 N4 -","- C20 H22 N4 -","- C40 H44 N8 -","2","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.0538","0.0421","","","0.1057","0.1137","","","","","","1.058","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029772","14.3618","0.001","7.5472","0.0006","18.9922","0.0014","90","","91.838","0.004","90","","2057.5","0.3","273","2","273","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","melamine + uracil","","","- C7 H10 N8 O2 -","- C7 H10 N8 O2 -","- C56 H80 N64 O16 -","8","1","","Thomas, Reji; Kulkarni, G. U.","A hydrogen-bonded channel structure formed by a complex of uracil and melamine.","Beilstein journal of organic chemistry","2007","3","1","17","","10.1186/1860-5397-3-17","","","0.71073","MoKα","","0.0443","0.0373","","","0.1053","0.1089","","","","","","1.043","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029773","11.3537","0.0003","15.5301","0.0004","18.6701","0.0005","81.989","0.002","76.082","0.002","78.338","0.001","3115.09","0.14","120","2","120","2","","","","","","","","6","P -1","-P 1","2","","","","- C63 H97 N8 O6 P S -","- C63 H97 N8 O6 P S -","- C126 H194 N16 O12 P2 S2 -","2","1","","Makuc, Damjan; Hiscock, Jennifer R.; Light, Mark E.; Gale, Philip A.; Plavec, Janez","NMR studies of anion-induced conformational changes in diindolylureas and diindolylthioureas.","Beilstein journal of organic chemistry","2011","7","","1205","1214","10.3762/bjoc.7.140","","","0.71073","MoKα","","0.1427","0.0779","","","0.1773","0.2069","","","","","","1.03","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029774","17.0057","0.0002","8.9486","0.0001","34.3882","0.0005","90","","98.2202","0.0006","90","","5179.33","0.11","90","0.2","90","0.2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H20 N4 -","- C19 H20 N4 -","- C228 H240 N48 -","12","3","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.1268","0.067","","","0.1751","0.2107","","","","","","1.051","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029775","6.6454","0.0003","17.9624","0.0009","9.3062","0.0004","90","","98.981","0.004","90","","1097.24","0.09","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H31 N O4 -","- C24 H31 N O4 -","- C48 H62 N2 O8 -","2","1","","Adalder, Tapas Kumar; Adarsh, N. N.; Sankolli, Ravish; Dastidar, Parthasarathi","Chiral gels derived from secondary ammonium salts of (1R,3S)-(+)-camphoric acid.","Beilstein journal of organic chemistry","2010","6","","848","858","10.3762/bjoc.6.100","","","0.71073","MoKα","","0.0845","0.0462","","","0.1039","0.1153","","","","","","0.923","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029776","33.1028","0.0005","6.1643","0.0001","20.2723","0.0004","90","","125.581","0.0011","90","","3364.33","0.11","90","0.2","90","0.2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C17 H28 N4 -","- C17 H28 N4 -","- C136 H224 N32 -","8","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.089","0.0516","","","0.1242","0.1436","","","","","","1.028","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029777","13.3991","0.0005","8.2341","0.0003","22.8014","0.0008","90","","96.356","0.002","90","","2500.2","0.16","120","2","120","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C17 H14 O -","- C17 H14 O -","- C136 H112 O8 -","8","1","","Cadman, Christopher J.; Croft, Anna K.","Anion-π interactions influence pK(a) values.","Beilstein journal of organic chemistry","2011","7","","320","328","10.3762/bjoc.7.42","","","0.71073","MoKα","","0.0821","0.0553","","","0.1463","0.1638","","","","","","1.046","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029778","8.6977","0.0009","12.5877","0.0013","18.8825","0.0019","90","","90","","90","","2067.3","0.4","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H33 N O4 -","- C18 H15 N O4 -","- C72 H60 N4 O16 -","4","1","","Adalder, Tapas Kumar; Adarsh, N. N.; Sankolli, Ravish; Dastidar, Parthasarathi","Chiral gels derived from secondary ammonium salts of (1R,3S)-(+)-camphoric acid.","Beilstein journal of organic chemistry","2010","6","","848","858","10.3762/bjoc.6.100","","","0.71073","MoKα","","0.082","0.0724","","","0.2043","0.223","","","","","","1.09","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029779","9.8002","0.0001","7.2445","0.0001","26.1183","0.0004","90","","94.6725","0.0006","90","","1848.17","0.04","90","0.2","90","0.2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H24 N4 -","- C21 H24 N4 -","- C84 H96 N16 -","4","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.0729","0.046","","","0.1194","0.1342","","","","","","1.058","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029780","9.2883","0.0009","11.2794","0.0011","11.673","0.0012","62.356","0.001","89.008","0.001","89.893","0.001","1083.15","0.19","173","","173","","","","","","","","","3","P -1","-P 1","2","","","","- C26 H20 O8 -","- C26 H20 O8 -","- C52 H40 O16 -","2","1","","Arimura, Junya; Mizuta, Tsutomu; Hiraga, Yoshikazu; Abe, Manabu","Formation of macrocyclic lactones in the Paternò-Büchi dimerization reaction.","Beilstein journal of organic chemistry","2011","7","","265","269","10.3762/bjoc.7.35","","","0.71073","MoKα","","0.0389","0.0356","","","0.1021","0.106","","","","","","0.984","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029781","12.2424","0.0015","17.278","0.002","16.726","0.0019","90","","98.199","0.002","90","","3501.8","0.7","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C34 H62 N2 O4 -","- C34 H62 N2 O4 -","- C136 H248 N8 O16 -","4","2","","Adalder, Tapas Kumar; Adarsh, N. N.; Sankolli, Ravish; Dastidar, Parthasarathi","Chiral gels derived from secondary ammonium salts of (1R,3S)-(+)-camphoric acid.","Beilstein journal of organic chemistry","2010","6","","848","858","10.3762/bjoc.6.100","","","0.71073","MoKα","","0.1194","0.1042","","","0.2406","0.2529","","","","","","1.219","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029782","5.7578","0.0003","10.3819","0.0004","15.1645","0.0007","86.213","0.002","79.332","0.003","84.967","0.002","886.24","0.07","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H20 N4 -","- C22 H20 N4 -","- C44 H40 N8 -","2","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","1.54178","CuKα","","0.0643","0.0444","","","0.1076","0.1177","","","","","","1.035","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029783","8.3106","0.0011","16.12","0.002","16.9678","0.0018","90","","90","","90","","2273.1","0.5","200","","200","","","","","","","","","5","P b c 21","P 2c -2b","29","","","","- C25 H33 B F3 N -","- C25 H33 B F3 N -","- C100 H132 B4 F12 N4 -","4","1","","Monot, Julien; Fensterbank, Louis; Malacria, Max; Lacôte, Emmanuel; Geib, Steven J.; Curran, Dennis P.","CAAC Boranes. Synthesis and characterization of cyclic (alkyl) (amino) carbene borane complexes from BF₃ and BH₃.","Beilstein journal of organic chemistry","2010","6","","709","712","10.3762/bjoc.6.82","","","0.71073","MoKα","","0.0867","0.0466","","0.1161","0.1007","0.1157","","","","","","0.9218","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4029784","7.2282","0.0001","14.5797","0.0003","18.0219","0.0004","90","","94.6029","0.0008","90","","1893.11","0.06","90","0.2","90","0.2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C23 H22 N4 -","- C23 H22 N4 -","- C92 H88 N16 -","4","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.0825","0.0483","","","0.1195","0.1367","","","","","","1.037","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029785","8.0309","0.0017","14.995","0.003","9.5461","0.0019","90","","106.162","0.004","90","","1104.1","0.4","203","2","203","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C23 H35 B F3 N -","- C23 H35 B F3 N -","- C46 H70 B2 F6 N2 -","2","0.5","","Monot, Julien; Fensterbank, Louis; Malacria, Max; Lacôte, Emmanuel; Geib, Steven J.; Curran, Dennis P.","CAAC Boranes. Synthesis and characterization of cyclic (alkyl) (amino) carbene borane complexes from BF₃ and BH₃.","Beilstein journal of organic chemistry","2010","6","","709","712","10.3762/bjoc.6.82","","","0.71073","MoKα","","0.0889","0.0647","","","0.1772","0.188","","","","","","1.363","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029786","11.5364","0.0002","10.5199","0.0002","31.4132","0.0006","90","","97.9299","0.0007","90","","3775.91","0.12","150","0.2","150","0.2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H32 N4 -","- C19 H32 N4 -","- C152 H256 N32 -","8","2","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.1119","0.0521","","","0.1281","0.1549","","","","","","0.988","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029787","29.889","0.003","5.2454","0.0005","31.439","0.003","90","","96.584","0.005","90","","4896.5","0.8","100","2","100","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C56 H48 N4 O12 -","- C56 H48 N4 O12 -","- C224 H192 N16 O48 -","4","1","","Castilla, Ana Maria; Morgan Conn, M.; Ballester, Pablo","Synthesis and binding studies of two new macrocyclic receptors for the stereoselective recognition of dipeptides.","Beilstein journal of organic chemistry","2010","6","","5","","10.3762/bjoc.6.5","","","0.71073","MoKα","","0.1867","0.0943","","","0.2314","0.2944","","","","","","1.038","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029788","5.717","0.0011","13.99","0.003","22.318","0.005","90","","93.12","0.03","90","","1782.4","0.7","90","2","90","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H22 N4 O -","- C19.768 H21.536 N4 O0.884 -","- C79.072 H86.144 N16 O3.536 -","4","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.078","0.0538","","","0.1456","0.1613","","","","","","1.038","","","","has coordinates,has disorder","178476","2020-10-21","18:00:00",""
"4029789","8.28","0.0003","9.8354","0.0005","10.7554","0.0004","90","","90","","90","","875.89","0.06","123","2","123","2","","","","","","","synthesis as described","5","P 21 a b","P -2b 2a","29","","","","- C6 H7 Cl I N -","- C6 H7 Cl I N -","- C24 H28 Cl4 I4 N4 -","4","1","","Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari","The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts.","Beilstein journal of organic chemistry","2010","6","","4","","10.3762/bjoc.6.4","","x-ray","0.71073","MoKα","","0.0209","0.0182","","","0.0328","0.0335","","","","","","1.045","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029790","10.065","0.0004","10.9183","0.0003","12.6269","0.0004","100.866","0.002","106.743","0.002","95.177","0.002","1289.45","0.08","123","2","123","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C6 H7 Br I N -","- C6 H7 Br I N -","- C36 H42 Br6 I6 N6 -","6","3","","Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari","The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts.","Beilstein journal of organic chemistry","2010","6","","4","","10.3762/bjoc.6.4","","x-ray","0.71073","MoKα","","0.0688","0.0543","","","0.1295","0.1374","","","","","","1.058","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029791","7.8119","0.0001","9.8242","0.0002","25.8681","0.0005","90","","90","","90","","1985.26","0.06","123","2","123","2","","","","","","","synthesis as described","6","P c a b","-P 2bc 2ac","61","","","","- C6 H9 I N O4 P -","- C6 H9 I N O4 P -","- C48 H72 I8 N8 O32 P8 -","8","1","","Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari","The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts.","Beilstein journal of organic chemistry","2010","6","","4","","10.3762/bjoc.6.4","","x-ray","0.71073","MoKα","","0.025","0.0228","","","0.0499","0.0509","","","","","","1.151","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029792","7.8654","0.0002","9.6441","0.0003","25.0515","0.0004","90","","90","","90","","1900.27","0.08","123","2","123","2","","","","","","","synthesis as described","6","P c a b","-P 2bc 2ac","61","","","","- C6 H9 Cl N O4 P -","- C6 H9 Cl N O4 P -","- C48 H72 Cl8 N8 O32 P8 -","8","1","","Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari","The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts.","Beilstein journal of organic chemistry","2010","6","","4","","10.3762/bjoc.6.4","","x-ray","0.71073","MoKα","","0.045","0.036","","","0.0857","0.0897","","","","","","1.056","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029793","8.1841","0.0001","16.9194","0.0002","20.4094","0.0003","90","","94.603","0.0007","90","","2816.98","0.06","123","2","123","2","","","","","","","synthesis as described","6","P 1 21/n 1","-P 2yn","14","","","","- C13 H15 Cl I N O -","- C13 H15 Cl I N O -","- C104 H120 Cl8 I8 N8 O8 -","8","2","","Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari","The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts.","Beilstein journal of organic chemistry","2010","6","","4","","10.3762/bjoc.6.4","","x-ray","0.71073","MoKα","","0.0425","0.0332","","","0.0648","0.0679","","","","","","1.038","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029794","8.1913","0.0001","11.4208","0.0002","17.9429","0.0003","80.027","0.001","78.217","0.001","76.302","0.001","1582.66","0.04","123","2","123","2","","","","","","","synthesis as described","6","P -1","-P 1","2","","","","- C5.5 H6.5 Cl I N O0.25 -","- C5.5 H6.5 Cl I N O0.25 -","- C44 H52 Cl8 I8 N8 O2 -","8","4","","Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari","The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts.","Beilstein journal of organic chemistry","2010","6","","4","","10.3762/bjoc.6.4","","x-ray","0.71073","MoKα","","0.0442","0.0326","","","0.0667","0.0722","","","","","","1.022","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029795","8.1247","0.0002","8.4128","0.0002","11.7526","0.0003","87.9511","0.0016","73.0323","0.0019","62.9872","0.0016","680.09","0.03","123","2","123","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C13 H9 I N2 O6 -","- C13 H9 I N2 O6 -","- C26 H18 I2 N4 O12 -","2","1","","Raatikainen, Kari; Cametti, Massimo; Rissanen, Kari","The subtle balance of weak supramolecular interactions: The hierarchy of halogen and hydrogen bonds in haloanilinium and halopyridinium salts.","Beilstein journal of organic chemistry","2010","6","","4","","10.3762/bjoc.6.4","","x-ray","0.71073","MoKα","","0.025","0.0228","","","0.0496","0.0504","","","","","","1.071","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029796","9.3059","0.0006","12.1138","0.0008","16.5226","0.0011","90","","100.91","0.002","90","","1828.9","0.2","90","0.2","90","0.2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H32 N4 -","- C19 H32 N4 -","- C76 H128 N16 -","4","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","1.54178","CuKα","","0.0379","0.0357","","","0.0896","0.0919","","","","","","1.031","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029797","14.3412","0.0003","10.9327","0.0003","11.1408","0.0004","90","","91.0293","0.0011","90","","1746.46","0.09","90","0.2","90","0.2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H30 N4 -","- C18 H30 N4 -","- C72 H120 N16 -","4","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.074","0.0443","","","0.1077","0.1196","","","","","","1.07","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029798","9.3343","0.0004","9.6107","0.0004","12.4635","0.0007","70.786","0.002","74.417","0.002","67.211","0.002","960.51","0.08","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C21 H30 N4 -","- C21 H30 N4 -","- C42 H60 N8 -","2","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.0698","0.0476","","","0.1158","0.1299","","","","","","1.046","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029799","10.7318","0.0002","11.9553","0.0002","17.3861","0.0003","106.348","0.0007","91.1499","0.0007","111.053","0.0007","1979.23","0.06","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H26 N4 -","- C22 H26 N4 -","- C88 H104 N16 -","4","2","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.1196","0.0527","","","0.1149","0.1394","","","","","","0.971","","","","has coordinates","178476","2020-10-21","18:00:00",""
"4029800","8.9442","0.0005","9.2587","0.0006","12.0545","0.0008","74.61","0.003","82.151","0.003","68.098","0.003","892.2","0.1","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C20 H28 N4 -","- C20 H28 N4 -","- C40 H56 N8 -","2","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.1011","0.0576","","","0.1345","0.1551","","","","","","1.048","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029801","10.2471","0.0002","10.8387","0.0002","13.1028","0.0002","73.0483","0.0008","69.9698","0.0009","88.6849","0.0007","1303.04","0.04","90","0.2","90","0.2","","","","","","","","3","P -1","-P 1","2","","","","- C32 H30 N6 -","- C32 H30 N6 -","- C64 H60 N12 -","2","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.0932","0.0485","","","0.1162","0.1353","","","","","","1.002","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029802","5.5435","0.0001","27.744","0.0005","10.0705","0.0002","90","","96.989","0.001","90","","1537.32","0.05","90","0.2","90","0.2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H26 N4 -","- C16 H26 N4 -","- C64 H104 N16 -","4","1","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","1.54178","CuKα","","0.0488","0.0386","","","0.0924","0.0988","","","","","","1.04","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029803","18.066","0.004","10.234","0.002","22.275","0.005","90","","90","","90","","4118.4","1.5","173","2","173","1","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C18 H29 N5 O2 -","- C18 H29 N5 O2 -","- C144 H232 N40 O16 -","8","2","","Long, Sihui; Muthusamy, Venkatraj; Willis, Peter G.; Parkin, Sean; Cammers, Arthur","Inversion symmetry and local vs. dispersive interactions in the nucleation of hydrogen bonded cyclic n-mer and tape of imidazolecarboxamidines.","Beilstein journal of organic chemistry","2008","4","","23","","10.3762/bjoc.4.23","","","0.71073","MoKα","","0.0908","0.0737","","","0.1638","0.1728","","","","","","1.116","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029804","21.483","0.003","21.483","0.003","14.924","0.003","90","","90","","120","","5964.9","1.7","168","2","168","2","","","","","","","","5","P 32","P 32","145","","","","- C30 H27 Cl2 N O3 -","- C30 H27 Cl2 N O3 -","- C270 H243 Cl18 N9 O27 -","9","3","","Akalay, Deniz; Dürner, Gerd; Bats, Jan W.; Göbel, Michael W","C2-symmetric bisamidines: chiral Brønsted bases catalysing the Diels-Alder reaction of anthrones.","Beilstein journal of organic chemistry","2008","4","","28","","10.3762/bjoc.4.28","","","0.71073","MoKα","","0.182","0.0604","","","0.0948","0.1194","","","","","","0.889","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029805","11.2325","0.0018","13.594","0.003","15.866","0.004","90","","90","","90","","2422.7","0.9","163","2","163","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H29 N O3 -","- C30 H29 N O3 -","- C120 H116 N4 O12 -","4","1","","Akalay, Deniz; Dürner, Gerd; Bats, Jan W.; Göbel, Michael W","C2-symmetric bisamidines: chiral Brønsted bases catalysing the Diels-Alder reaction of anthrones.","Beilstein journal of organic chemistry","2008","4","","28","","10.3762/bjoc.4.28","","","0.71073","MoKα","","0.1409","0.0542","","","0.0955","0.1177","","","","","","1.022","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029806","11.9956","0.001","19.4176","0.0016","39.769","0.003","90.915","0.002","92.614","0.002","91.654","0.002","9248.3","1.3","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C74 H44 F68 I4 O4.5 -","- C74 H44 F68 I4 O4.5 -","- C296 H176 F272 I16 O18 -","4","2","","Osipov, Maksim; Chu, Qianli; Geib, Steven J.; Curran, Dennis P.; Weber, Stephen G.","Synthesis of deep-cavity fluorous calix[4]arenes as molecular recognition scaffolds.","Beilstein journal of organic chemistry","2008","4","","36","","10.3762/bjoc.4.36","","","0.71073","MoKα","","0.1988","0.1364","","","0.3055","0.3243","","","","","","1.789","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4029830","5.2508","0.0005","14.2668","0.0012","19.7267","0.0013","90","","90","","90","","1477.8","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 Cl2 O3 -","- C13 H15 Cl2 O4 -","- C52 H60 Cl8 O16 -","4","1","","Ding, Haixin; Li, Wei; Ruan, Zhizhong; Yang, Ruchun; Mao, Zhijie; Xiao, Qiang; Wu, Jun","Concise total synthesis of two marine natural nucleosides: trachycladines A and B.","Beilstein journal of organic chemistry","2014","10","","1681","1685","10.3762/bjoc.10.176","","","0.71073","MoKα","","0.0756","0.0548","","","0.1668","0.1984","","","","","","0.791","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029844","8.2597","0.0009","9.772","0.001","11.0233","0.0009","95.851","0.007","99.783","0.008","100.761","0.009","853.13","0.15","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","cyclo-bis(ethinyldiphenylurea) - bis(dimethylformamide)","","- C40 H34 N6 O4 -","- C40 H34 N6 O4 -","- C40 H34 N6 O4 -","1","0.5","","Kretschmer, Claudia; Dittmann, Gertrud; Beck, Johannes","Macrocyclic bis(ureas) as ligands for anion complexation.","Beilstein journal of organic chemistry","2014","10","","1834","1839","10.3762/bjoc.10.193","","","0.71073","MoKα","","0.0727","0.0364","","","0.0903","0.1048","","","","","","0.991","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029845","8.2244","0.0013","17.995","0.002","12.1198","0.0017","90","","113.483","0.01","90","","1645.1","0.4","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","cyclo-bis(ethinyldiphenylurea) - bis(dimethylsulfoxide)","","- C38 H32 N4 O4 S2 -","- C38 H32 N4 O4 S2 -","- C76 H64 N8 O8 S4 -","2","0.5","","Kretschmer, Claudia; Dittmann, Gertrud; Beck, Johannes","Macrocyclic bis(ureas) as ligands for anion complexation.","Beilstein journal of organic chemistry","2014","10","","1834","1839","10.3762/bjoc.10.193","","","0.71073","MoKα","","0.1531","0.0522","","","0.0803","0.1038","","","","","","0.738","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029846","12.7152","0.0006","17.5556","0.0008","20.5472","0.0008","90","","125.548","0.003","90","","3731.8","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Tetraethylammonium-cyclo-bis(butadiynyldiphenylurea)-bromide complex","","- C42 H40 Br N5 O2 -","- C42 H40 Br N5 O2 -","- C168 H160 Br4 N20 O8 -","4","1","","Kretschmer, Claudia; Dittmann, Gertrud; Beck, Johannes","Macrocyclic bis(ureas) as ligands for anion complexation.","Beilstein journal of organic chemistry","2014","10","","1834","1839","10.3762/bjoc.10.193","","","0.71073","MoKα","","0.1654","0.0617","","","0.123","0.1628","","","","","","1.005","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029847","11.8302","0.0016","7.098","0.0015","13.47","0.0013","90","","102.437","0.008","90","","1104.5","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","Dihydroindoloquinolinone","","- C15 H10 N2 O -","- C15 H10 N2 O -","- C60 H40 N8 O4 -","4","1","","Kretschmer, Claudia; Dittmann, Gertrud; Beck, Johannes","Macrocyclic bis(ureas) as ligands for anion complexation.","Beilstein journal of organic chemistry","2014","10","","1834","1839","10.3762/bjoc.10.193","","","0.71073","MoKα","","0.0988","0.0421","","","0.0978","0.116","","","","","","0.985","","","","has coordinates","178477","2020-10-21","18:00:00",""
"4029967","9.8661","0.0002","12.1391","0.0003","12.6797","0.0003","74.046","0.002","77.445","0.002","67.218","0.002","1335.61","0.06","296","2","293","","","","","","","","","5","P -1","-P 1","2","","","","- C14 H12 F3 N O3 -","- C14 H12 F3 N O3 -","- C56 H48 F12 N4 O12 -","4","2","","Kim, JungKeun; Shokova, Elvira; Tafeenko, Victor; Kovalev, Vladimir","(CF3CO)2O/CF3SO3H-mediated synthesis of 1,3-diketones from carboxylic acids and aromatic ketones.","Beilstein journal of organic chemistry","2014","10","","2270","2278","10.3762/bjoc.10.236","","","1.54186","CuKα","","0.1014","0.0422","","","0.1033","0.1203","","","","","","0.701","","","","has coordinates","178478","2020-10-21","18:00:00",""
"4029968","6.872","0.0002","22.4177","0.0004","7.7044","0.0002","90","","90.798","0.002","90","","1186.78","0.05","293","2","295","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H14 Cl N O2 -","- C12 H14 Cl N O2 -","- C48 H56 Cl4 N4 O8 -","4","1","","Kim, JungKeun; Shokova, Elvira; Tafeenko, Victor; Kovalev, Vladimir","(CF3CO)2O/CF3SO3H-mediated synthesis of 1,3-diketones from carboxylic acids and aromatic ketones.","Beilstein journal of organic chemistry","2014","10","","2270","2278","10.3762/bjoc.10.236","","","1.54086","CuKα","","0.0735","0.0507","","","0.1203","0.1283","","","","","","0.875","","","","has coordinates","178478","2020-10-21","18:00:00",""
"4029969","4.7721","0.0001","11.6674","0.0004","28.3435","0.0007","90","","91.577","0.001","90","","1577.51","0.07","295","2","295","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","7-bromo-3-(bromphenyl)-2,4-dihydro-indeno[1,2-c]pyrazole","","","- C18 H14 Br2 N2 -","- C18 H14 Br2 N2 -","- C72 H56 Br8 N8 -","4","1","","Kim, JungKeun; Shokova, Elvira; Tafeenko, Victor; Kovalev, Vladimir","(CF3CO)2O/CF3SO3H-mediated synthesis of 1,3-diketones from carboxylic acids and aromatic ketones.","Beilstein journal of organic chemistry","2014","10","","2270","2278","10.3762/bjoc.10.236","","","1.54186","CuKα","","0.0521","0.04","","","0.0971","0.1001","","","","","","0.902","","","","has coordinates","178478","2020-10-21","18:00:00",""
"4029970","6.5776","0.0003","7.4148","0.0003","17.7488","0.0009","100.413","0.004","92.503","0.004","104.794","0.004","819.48","0.07","295","2","295","","","","","","","","","3","P -1","-P 1","2","","","","- C21 H24 O2 -","- C21 H24 O2 -","- C42 H48 O4 -","2","1","","Kim, JungKeun; Shokova, Elvira; Tafeenko, Victor; Kovalev, Vladimir","(CF3CO)2O/CF3SO3H-mediated synthesis of 1,3-diketones from carboxylic acids and aromatic ketones.","Beilstein journal of organic chemistry","2014","10","","2270","2278","10.3762/bjoc.10.236","","","1.54086","CuKα","","0.0836","0.063","","","0.1678","0.1853","","","","","","0.752","","","","has coordinates","178478","2020-10-21","18:00:00",""
"4029994","7.4466","0.0008","11.1033","0.0012","12.5493","0.0013","74.933","0.005","73.64","0.005","78.131","0.005","951.49","0.18","296","2","296","2","","","","","","","","5","P -1","-P 1","2","","","","- C22 H17 F3 N2 O2 -","- C22 H17 F3 N2 O2 -","- C44 H34 F6 N4 O4 -","2","1","","Zhou, Xiaoli; Liu, Meiling; Luo, Puying; Lai, Yingjun; Yang, Tangtao; Ding, Qiuping","Synthesis of 2-trifluoromethylpyrazolo[5,1-a]isoquinolines via silver triflate-catalyzed or electrophile-mediated one-pot tandem reaction.","Beilstein journal of organic chemistry","2014","10","","2286","2292","10.3762/bjoc.10.238","","","0.71073","MoKα","","0.1102","0.0792","","","0.224","0.2589","","","","","","1.071","","","","has coordinates","178478","2020-10-21","18:00:00",""
"4029995","19.222","0.008","13.042","0.005","14.091","0.006","90","","95.239","0.005","90","","3518","2","296","2","296","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C18 H13 F3 I N2 O2 -","- C18 H14 F3 I N2 O2 -","- C144 H112 F24 I8 N16 O16 -","8","1","","Zhou, Xiaoli; Liu, Meiling; Luo, Puying; Lai, Yingjun; Yang, Tangtao; Ding, Qiuping","Synthesis of 2-trifluoromethylpyrazolo[5,1-a]isoquinolines via silver triflate-catalyzed or electrophile-mediated one-pot tandem reaction.","Beilstein journal of organic chemistry","2014","10","","2286","2292","10.3762/bjoc.10.238","","","0.71073","MoKα","","0.0487","0.0409","","","0.1051","0.1118","","","","","","1.004","","","","has coordinates,has disorder","178478","2020-10-21","18:00:00",""
"4030315","13.5133","0.0016","13.5483","0.0008","9.6825","0.0005","90","","92.293","0.007","90","","1771.3","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 Br N2 O3 -","- C18 H17 Br N2 O4 -","- C72 H68 Br4 N8 O16 -","4","1","","Singh, Radhey Mohan; Bharadwaj, Kishor Chandra; Tiwari, Dharmendra Kumar","Morita-Baylis-Hillman reaction of acrylamide with isatin derivatives.","Beilstein journal of organic chemistry","2014","10","","2975","2980","10.3762/bjoc.10.315","","","0.71073","MoKα","","0.2039","0.0639","","","0.106","0.1475","","","","","","0.943","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4030342","11.9769","0.0012","6.797","0.0007","19.8608","0.0019","90","","90.491","0.002","90","","1616.7","0.3","186","2","186","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 N4 S -","- C20 H14 N4 S -","- C80 H56 N16 S4 -","4","1","","Samanta, Debabrata; Rana, Anup; Bats, Jan W.; Schmittel, Michael","A one-pot multistep cyclization yielding thiadiazoloimidazole derivatives","Beilstein Journal of Organic Chemistry","2014","10","","2989","","10.3762/bjoc.10.317","","","0.71073","MoKα","","0.1359","0.0729","","","0.1319","0.1535","","","","","","1.043","","","","has coordinates","178482","2020-10-21","18:00:00",""
"4030436","30.367","0.003","11.8122","0.0009","19.5189","0.0016","90","","96.413","0.002","90","","6957.6","1","150","2","150","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C19 H18 B F2 N3 O2 -","- C19 H18 B F2 N3 O2 -","- C304 H288 B16 F32 N48 O32 -","16","2","","Yu, Mingfeng; Wong, Joseph K.-H.; Tang, Cyril; Turner, Peter; Todd, Matthew H.; Rutledge, Peter J.","Efficient deprotection of F-BODIPY derivatives: removal of BF2 using Brønsted acids.","Beilstein journal of organic chemistry","2015","11","","37","41","10.3762/bjoc.11.6","","","0.71073","MoKα","","0.0551","0.0415","","","0.1284","0.1487","","","","","","1.464","","","","has coordinates","178483","2020-10-21","18:00:00",""
"4030514","15.8768","0.0008","9.2589","0.0005","14.0614","0.0007","90","","108.877","0.001","90","","1955.87","0.17","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","Benzoylphosphonodiamidite","(bis(diisopropylamino)phosphanyl)(phenyl)methanone","","- C19 H33 N2 O P -","- C19 H33 N2 O P -","- C76 H132 N8 O4 P4 -","4","1","","Hersh, William H.","Synthesis of dinucleoside acylphosphonites by phosphonodiamidite chemistry and investigation of phosphorus epimerization.","Beilstein journal of organic chemistry","2015","11","","184","191","10.3762/bjoc.11.19","","","0.71073","MoKα","","0.0343","0.0311","","","0.0795","0.0821","","","","","","1.048","","","","has coordinates","178484","2020-10-21","18:00:00",""
"4030944","5.0849","0.0005","10.9285","0.0012","12.7619","0.0013","90","","97.741","0.012","90","","702.72","0.13","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","EDT-TTF(CN)(CF3)","","","- C10 H4 F3 N S6 -","- C10 H4 F3 N S6 -","- C20 H8 F6 N2 S12 -","2","1","","Jeannin, Olivier; Barrière, Frédéric; Fourmigué, Marc","Trifluoromethyl-substituted tetrathiafulvalenes.","Beilstein journal of organic chemistry","2015","11","","647","658","10.3762/bjoc.11.73","","","0.71073","MoKα","","0.0557","0.0327","","","0.0691","0.0765","","","","","","0.954","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4030945","5.1515","0.0012","11.998","0.002","12.974","0.003","103.96","0.03","90.02","0.03","90.45","0.03","778.2","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","EDT-TTF(CO2Me)(CF3)","3,4-ethylendithio-3'-carbomethoxy-4'-trifluoromethyltetrathiafulvalene ?","","- C11 H7 F3 O2 S6 -","- C11 H7 F3 O2 S6 -","- C22 H14 F6 O4 S12 -","2","1","","Jeannin, Olivier; Barrière, Frédéric; Fourmigué, Marc","Trifluoromethyl-substituted tetrathiafulvalenes.","Beilstein journal of organic chemistry","2015","11","","647","658","10.3762/bjoc.11.73","","","0.71073","MoKα","","0.1597","0.0442","","","0.0691","0.0909","","","","","","0.702","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4030946","7.4209","0.0008","17.0659","0.0017","13.5707","0.0015","90","","97.834","0.013","90","","1702.6","0.3","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","o-(CF3)2-TTF-o-(CO2Me)","4,5-bis(trifluoromethyl)-4',5'-bis(methoxycarbonyl)tetrathiafulvalene","","- C12 H6 F6 O4 S4 -","- C12 H6 F6 O4 S4 -","- C48 H24 F24 O16 S16 -","4","1","","Jeannin, Olivier; Barrière, Frédéric; Fourmigué, Marc","Trifluoromethyl-substituted tetrathiafulvalenes.","Beilstein journal of organic chemistry","2015","11","","647","658","10.3762/bjoc.11.73","","","0.71073","MoKα","","0.0612","0.032","","","0.0706","0.0783","","","","","","0.898","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4030947","28","0.003","8.7129","0.0009","7.2091","0.0007","90","","90","","90","","1758.7","0.3","293","2","293","2","","","","","","","","5","P b a m","-P 2 2ab","55","E-(CF3,CO2Me)2 TTF","Trans-4,4'-bis(trifluoromethyl)-5,5'-bis(methoxycarbonyl)tetrathiafulvalene","","- C12 H6 F6 O4 S4 -","- C12 H6 F6 O4 S4 -","- C48 H24 F24 O16 S16 -","4","0.5","","Jeannin, Olivier; Barrière, Frédéric; Fourmigué, Marc","Trifluoromethyl-substituted tetrathiafulvalenes.","Beilstein journal of organic chemistry","2015","11","","647","658","10.3762/bjoc.11.73","","","0.71073","MoKα","","0.1057","0.0342","","","0.053","0.0647","","","","","","0.767","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4030948","13.2146","0.0015","11.1448","0.0008","13.1662","0.0015","90","","106.997","0.013","90","","1854.3","0.4","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(EDT TTF CF3)2 TCNQ","","","- C15 H7 F3 N2 S6 -","- C15 H7 F3 N2 S6 -","- C60 H28 F12 N8 S24 -","4","1","","Jeannin, Olivier; Barrière, Frédéric; Fourmigué, Marc","Trifluoromethyl-substituted tetrathiafulvalenes.","Beilstein journal of organic chemistry","2015","11","","647","658","10.3762/bjoc.11.73","","","0.71073","MoKα","","0.0692","0.0339","","","0.073","0.0814","","","","","","0.868","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4030949","5.9348","0.0005","14.4165","0.0015","21.785","0.002","90","","90","","90","","1863.9","0.3","150","2","150","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","EDT-TTF-CF3, FeCl4","","","- C9 H5 Cl4 F3 Fe S6 -","- C9 H5 Cl4 F3 Fe S6 -","- C36 H20 Cl16 F12 Fe4 S24 -","4","1","","Jeannin, Olivier; Barrière, Frédéric; Fourmigué, Marc","Trifluoromethyl-substituted tetrathiafulvalenes.","Beilstein journal of organic chemistry","2015","11","","647","658","10.3762/bjoc.11.73","","","0.71073","MoKα","","0.0675","0.0411","","","0.0497","0.0545","","","","","","1.066","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4030950","9.4587","0.0005","9.6256","0.0004","11.5993","0.0006","90","","90","","90","","1056.07","0.09","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H10 O S3 -","- C9 H10 O S3 -","- C36 H40 O4 S12 -","4","1","","Silva, Rafaela A. L.; Vieira, Bruno J. C.; Andrade, Marta M.; Santos, Isabel C.; Rabaça, Sandra; Belo, Dulce; Almeida, Manuel","TTFs nonsymmetrically fused with alkylthiophenic moieties.","Beilstein journal of organic chemistry","2015","11","","628","637","10.3762/bjoc.11.71","","","0.71073","MoKα","","0.0398","0.0329","","","0.0767","0.0793","","","","","","1.075","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"4030951","9.9526","0.0003","12.2499","0.0003","17.9352","0.0004","81.381","0.001","85.234","0.002","89.204","0.001","2154.46","0.1","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C18 H18 N2 S7 -","- C18 H18 N2 S7 -","- C72 H72 N8 S28 -","4","2","","Silva, Rafaela A. L.; Vieira, Bruno J. C.; Andrade, Marta M.; Santos, Isabel C.; Rabaça, Sandra; Belo, Dulce; Almeida, Manuel","TTFs nonsymmetrically fused with alkylthiophenic moieties.","Beilstein journal of organic chemistry","2015","11","","628","637","10.3762/bjoc.11.71","","","0.71073","MoKα","","0.071","0.0387","","","0.0828","0.0904","","","","","","1.019","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"4030952","7.253","0.0001","8.3877","0.0001","26.2705","0.0004","86.235","0.001","86.176","0.001","71.72","0.001","1512.47","0.04","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H12 Au N6 S11 -","- C23 H12 Au N6 S11 -","- C46 H24 Au2 N12 S22 -","2","1","","Silva, Rafaela A. L.; Vieira, Bruno J. C.; Andrade, Marta M.; Santos, Isabel C.; Rabaça, Sandra; Belo, Dulce; Almeida, Manuel","TTFs nonsymmetrically fused with alkylthiophenic moieties.","Beilstein journal of organic chemistry","2015","11","","628","637","10.3762/bjoc.11.71","","","0.71073","MoKα","","0.0175","0.0173","","","0.042","0.0421","","","","","","1.253","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"4031010","21.0945","0.0005","13.8077","0.0007","12.4172","0.0002","90","","90","","90","","3616.7","0.2","293","2","293","2","","","","","","","","5","P b c n","-P 2n 2ab","60","(TTF1)(CuBr4)","(TTF1)(CuBr4)","","- C30 H20 Br4 Cu S8 -","- C30 H20 Br4 Cu S8 -","- C120 H80 Br16 Cu4 S32 -","4","0.5","","Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng","Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties.","Beilstein journal of organic chemistry","2015","11","","850","859","10.3762/bjoc.11.95","","","1.54184","CuKα","","0.055","0.0458","","","0.1168","0.1261","","","","","","1.045","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031011","13.9096","0.0007","14.1046","0.0007","21.077","0.001","90","","107.985","0.006","90","","3933","0.4","293","2","293","2","","","","","","","","5","I 1 2/a 1","-I 2ya","15","(TTF2)(CuBr4)","(TTF2)(CuBr4)","","- C34 H28 Br4 Cu S8 -","- C34 H28 Br4 Cu S8 -","- C136 H112 Br16 Cu4 S32 -","4","0.5","","Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng","Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties.","Beilstein journal of organic chemistry","2015","11","","850","859","10.3762/bjoc.11.95","","","0.71073","MoKα","","0.1102","0.0494","","","0.0831","0.1037","","","","","","0.974","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031012","13.0614","0.0006","13.3435","0.0006","14.5787","0.0007","102.051","0.006","92.764","0.006","116.503","0.007","2194.5","0.2","173","2","173","2","","","","","","","","6","P -1","-P 1","2","(TTF3)(CuBr4)0.5(CuBr3)THF","(TTF3)(CuBr4)0.5(CuBr3)THF","","- C76 H72 Br10 Cu3 O2 S16 -","- C76 H72 Br10 Cu3 O2 S16 -","- C76 H72 Br10 Cu3 O2 S16 -","1","0.5","","Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng","Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties.","Beilstein journal of organic chemistry","2015","11","","850","859","10.3762/bjoc.11.95","","","0.71073","MoKα","","0.0834","0.0532","","","0.1133","0.1287","","","","","","1.035","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031013","13.1368","0.0005","13.4389","0.0005","14.8346","0.0005","101.664","0.003","93.457","0.003","116.863","0.004","2253.37","0.17","291","2","291","2","","","","","","","","6","P -1","-P 1","2","(TTF3)(CuBr4)0.5(CuBr3)THF","(TTF3)(CuBr4)0.5(CuBr3)THF","","- C76 H72 Br10 Cu3 O2 S16 -","- C76 H72 Br10 Cu3 O2 S16 -","- C76 H72 Br10 Cu3 O2 S16 -","1","0.5","","Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng","Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties.","Beilstein journal of organic chemistry","2015","11","","850","859","10.3762/bjoc.11.95","","","0.71073","MoKα","","0.1236","0.0591","","","0.1228","0.1544","","","","","","1.011","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031014","12.9103","0.0008","19.5008","0.0005","16.3696","0.0005","90","","90","","90","","4121.2","0.3","293","2","293","2","","","","","","","","6","P c c n","-P 2ab 2ac","56","(TTF4)(CuBr4)","(TTF4)(CuBr4)","","- C34 H28 Br4 Cu O4 S8 -","- C34 H28 Br4 Cu O4 S8 -","- C136 H112 Br16 Cu4 O16 S32 -","4","0.5","","Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng","Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties.","Beilstein journal of organic chemistry","2015","11","","850","859","10.3762/bjoc.11.95","","","0.71073","MoKα","","0.1377","0.0516","","","0.0704","0.0943","","","","","","1.004","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031015","8.8766","0.0005","11.3774","0.0005","12.1805","0.0005","92.375","0.003","105.574","0.004","112.882","0.004","1076.89","0.1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(TTF5)(Cu2Br6)","(TTF5)(Cu2Br6)","","- C34 H28 Br6 Cu2 O4 S8 -","- C34 H28 Br6 Cu2 O4 S8 -","- C34 H28 Br6 Cu2 O4 S8 -","1","0.5","","Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng","Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties.","Beilstein journal of organic chemistry","2015","11","","850","859","10.3762/bjoc.11.95","","","1.54184","CuKα","","0.0382","0.0354","","","0.0899","0.0927","","","","","","1.062","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031016","8.0605","0.0003","11.117","0.0007","13.7852","0.0006","89.253","0.004","88.684","0.004","80.707","0.004","1218.68","0.1","293","2","293","2","","","","","","","","7","P -1","-P 1","2","(TTF6)(CuBr2)(CH3CN)","(TTF6)(CuBr2)(CH3CN)","","- C40 H28 Br2 Cu N O8 S8 -","- C40 H28 Br2 Cu N O8 S8 -","- C40 H28 Br2 Cu N O8 S8 -","1","0.5","","Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng","Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties.","Beilstein journal of organic chemistry","2015","11","","850","859","10.3762/bjoc.11.95","","","0.71073","MoKα","","0.0934","0.0601","","","0.1618","0.1853","","","","","","1.037","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031017","12.8898","0.0012","14.8147","0.0013","14.8279","0.0013","107.327","0.008","93.858","0.007","115.35","0.009","2379.7","0.5","293","2","293","2","","","","","","","","6","P -1","-P 1","2","(TTF7)(CUBr2)","(TTF7)(CuBr2)","","- C42 H36 Br2 Cu O8 S8 -","- C42 H36 Br2 Cu O8 S8 -","- C84 H72 Br4 Cu2 O16 S16 -","2","1","","Ma, Longfei; Sun, Jibin; Lu, Xiaofeng; Zhang, Shangxi; Qi, Hui; Liu, Lei; Shao, Yongliang; Shao, Xiangfeng","Copper ion salts of arylthiotetrathiafulvalenes: synthesis, structure diversity and magnetic properties.","Beilstein journal of organic chemistry","2015","11","","850","859","10.3762/bjoc.11.95","","","0.71073","MoKα","","0.13","0.0839","","","0.2016","0.2466","","","","","","1.085","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031020","10.761","0.003","11.927","0.004","16.09","0.005","80.067","0.005","84.081","0.005","66.129","0.004","1858.9","1","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","2-[4,5-Bis(methylthio)-1,3-dithiol-2-ylidene]- 5-(4-methoxyphenyl)-5H-1,3-dithiolo[4,5-c]pyrrole","","- C17 H15 N O S6 -","- C17 H15 N O S6 -","- C68 H60 N4 O4 S24 -","4","2","","Azov, Vladimir A.; Janott, Diana; Schlüter, Dirk; Zeller, Matthias","Tuning of tetrathiafulvalene properties: versatile synthesis of N-arylated monopyrrolotetrathiafulvalenes via Ullmann-type coupling reactions.","Beilstein journal of organic chemistry","2015","11","","860","868","10.3762/bjoc.11.96","","","0.71073","MoKα","","0.0459","0.0381","","","0.1006","0.1081","","","","","","1.02","","","","has coordinates","140294","2020-10-21","18:00:00",""
"4031021","10.8196","0.0009","12.0793","0.001","19.096","0.0016","72.509","0.001","89.47","0.001","70.382","0.001","2230.5","0.3","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C21 H23 N O S6 -","- C21 H23 N O S6 -","- C84 H92 N4 O4 S24 -","4","2","","Azov, Vladimir A.; Janott, Diana; Schlüter, Dirk; Zeller, Matthias","Tuning of tetrathiafulvalene properties: versatile synthesis of N-arylated monopyrrolotetrathiafulvalenes via Ullmann-type coupling reactions.","Beilstein journal of organic chemistry","2015","11","","860","868","10.3762/bjoc.11.96","","","0.71073","MoKα","","0.0342","0.0266","","","0.0647","0.0703","","","","","","1.033","","","","has coordinates,has disorder","140294","2020-10-21","18:00:00",""
"4031022","10.9203","0.0013","11.8068","0.0014","34.711","0.004","90","","91.759","0.004","90","","4473.3","0.9","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","2-[4,5-Bis(propylthio)-1,3-dithiol-2-ylidene]- 5-(4-nitrophenyl)-5H-1,3-dithiolo[4,5-c]pyrrole","","- C20 H20 N2 O2 S6 -","- C20 H20 N2 O2 S6 -","- C160 H160 N16 O16 S48 -","8","2","","Azov, Vladimir A.; Janott, Diana; Schlüter, Dirk; Zeller, Matthias","Tuning of tetrathiafulvalene properties: versatile synthesis of N-arylated monopyrrolotetrathiafulvalenes via Ullmann-type coupling reactions.","Beilstein journal of organic chemistry","2015","11","","860","868","10.3762/bjoc.11.96","","","1.54178","CuKα","","0.0878","0.0846","","","0.2114","0.2126","","","","","","1.216","","","","has coordinates","140294","2020-10-21","18:00:00",""
"4031023","11.5871","0.0004","12.1431","0.0005","18.897","0.0008","94.0239","0.0014","90.9921","0.0013","117.911","0.0012","2339.99","0.16","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","2-[4,5-Bis(propylthio)-1,3-dithiol-2-ylidene]- 5-(4-dimethylaminophenyl)-5H-1,3-dithiolo[4,5-c]pyrrole","","- C22 H26 N2 S6 -","- C22 H26 N2 S6 -","- C88 H104 N8 S24 -","4","2","","Azov, Vladimir A.; Janott, Diana; Schlüter, Dirk; Zeller, Matthias","Tuning of tetrathiafulvalene properties: versatile synthesis of N-arylated monopyrrolotetrathiafulvalenes via Ullmann-type coupling reactions.","Beilstein journal of organic chemistry","2015","11","","860","868","10.3762/bjoc.11.96","","","0.71073","MoKα","","0.0642","0.048","","","0.1063","0.1162","","","","","","1.078","","","","has coordinates,has disorder","140294","2020-10-21","18:00:00",""
"4031037","12.2093","0.0006","13.8951","0.0009","19.7678","0.0013","98.263","0.002","96.719","0.002","90.646","0.002","3294.6","0.3","122","2","122","2","","","","","","","","4","P -1","-P 1","2","","","","- C60 H78 S12 Si2 -","- C59.453 H78 S12 Si2 -","- C118.906 H156 S24 Si4 -","2","1","","Jiang, Huixin; Mazzanti, Virginia; Parker, Christian R.; Broman, Søren Lindbæk; Wallberg, Jens Heide; Lušpai, Karol; Brincko, Adam; Kjaergaard, Henrik G.; Kadziola, Anders; Rapta, Peter; Hammerich, Ole; Nielsen, Mogens Brøndsted","Interactions between tetrathiafulvalene units in dimeric structures - the influence of cyclic cores.","Beilstein journal of organic chemistry","2015","11","","930","948","10.3762/bjoc.11.104","","","0.71073","MoKα","","0.1006","0.0641","","","0.1519","0.1737","","","","","","1.028","","","","has coordinates,has disorder","140295","2020-10-21","18:00:00",""
"4031095","23.4015","0.0002","34.9475","0.0002","39.9599","0.0004","90","","91.391","0.001","90","","32670.5","0.5","120","2","120","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C136 H120 F12 N24 O12 Pd6 S16 -","- C136 H120 F12 N24 O12 Pd6 S16 -","- C544 H480 F48 N96 O48 Pd24 S64 -","4","1","","Bivaud, Sébastien; Goeb, Sébastien; Croué, Vincent; Allain, Magali; Pop, Flavia; Sallé, Marc","Tuning the size of a redox-active tetrathiafulvalene-based self-assembled ring.","Beilstein journal of organic chemistry","2015","11","","966","971","10.3762/bjoc.11.108","","x-ray","0.67","synchrotron","","0.1043","0.0917","","","0.2636","0.2787","","","","","","1.057","","","","has coordinates","140292","2020-10-21","18:00:00",""
"4031145","7.8549","0.0006","21.3643","0.0015","6.9055","0.0005","90","","102.946","0.004","90","","1129.39","0.14","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C10 H19 N O5 -","- C10 H19 N O5 -","- C40 H76 N4 O20 -","4","1","","Shinde, Madhuri V.; Ople, Rohini S.; Sangtani, Ekta; Gonnade, Rajesh; Reddy, D. Srinivasa","Synthesis of novel N-cyclopentenyl-lactams using the Aubé reaction.","Beilstein journal of organic chemistry","2015","11","","1060","1067","10.3762/bjoc.11.119","","","0.71073","MoKα","","0.0501","0.0446","","","0.1156","0.1203","","","","","","1.034","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031358","16.798","0.013","7.072","0.005","9.043","0.007","90","","90","","90","","1074.3","1.4","125","","125","","","","","","","","","6","P n m a","-P 2ac 2n","62","","","","- C6 H4 B F9 N2 S -","- C6 H4 B F9 N2 S -","- C24 H16 B4 F36 N8 S4 -","4","0.5","","Iakobson, George; Du, Junyi; Slawin, Alexandra M. Z.; Beier, Petr","Pyridine-promoted dediazoniation of aryldiazonium tetrafluoroborates: Application to the synthesis of SF5-substituted phenylboronic esters and iodobenzenes.","Beilstein journal of organic chemistry","2015","11","","1494","1502","10.3762/bjoc.11.162","","","0.71075","MoKα","","","0.0806","","","","0.2938","","","","","","1.328","","","","has coordinates","160569","2020-10-21","18:00:00",""
"4031359","10.8224","0.0019","17.875","0.003","34.803","0.006","90","","90","","90","","6733","2","125","","125","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C6 H4 B F9 N2 S -","- C6 H4 B F9 N2 S -","- C144 H96 B24 F216 N48 S24 -","24","3","","Iakobson, George; Du, Junyi; Slawin, Alexandra M. Z.; Beier, Petr","Pyridine-promoted dediazoniation of aryldiazonium tetrafluoroborates: Application to the synthesis of SF5-substituted phenylboronic esters and iodobenzenes.","Beilstein journal of organic chemistry","2015","11","","1494","1502","10.3762/bjoc.11.162","","","0.71075","MoKα","","","0.1339","","","","0.2412","","","","","","1.345","","","","has coordinates","160569","2020-10-21","18:00:00",""
"4031363","18.848","0.004","25.98","0.005","10.209","0.002","90","","90","","90","","4999.1","1.7","93","2","93","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C33.25 H25.5 Cl0.5 P -","- C33.25 H25.5 Cl0.5 P -","- C266 H204 Cl4 P8 -","8","2","","Guidone, Stefano; Nahra, Fady; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Ruthenium indenylidene ""1(st) generation"" olefin metathesis catalysts containing triisopropyl phosphite.","Beilstein journal of organic chemistry","2015","11","","1520","1527","10.3762/bjoc.11.166","","","0.71073","MoKα","","0.1053","0.0796","","","0.2041","0.2199","","","","","","0.944","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4031364","13.703","0.002","16.085","0.003","41.003","0.007","90","","90","","90","","9038","3","125","2","125","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C45 H71 Cl2 O3 P2 Ru -","- C45 H71 Cl2 O3 P2 Ru -","- C360 H568 Cl16 O24 P16 Ru8 -","8","1","","Guidone, Stefano; Nahra, Fady; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Ruthenium indenylidene ""1(st) generation"" olefin metathesis catalysts containing triisopropyl phosphite.","Beilstein journal of organic chemistry","2015","11","","1520","1527","10.3762/bjoc.11.166","","","0.71073","MoKα","","0.0992","0.073","","","0.198","0.2295","","","","","","1.27","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031365","13.067","0.002","15.91","0.002","37.178","0.006","90","","90","","90","","7729","2","93","2","93","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C33 H52 Cl2 O6 P2 Ru -","- C33 H52 Cl2 O6 P2 Ru -","- C264 H416 Cl16 O48 P16 Ru8 -","8","1","","Guidone, Stefano; Nahra, Fady; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Ruthenium indenylidene ""1(st) generation"" olefin metathesis catalysts containing triisopropyl phosphite.","Beilstein journal of organic chemistry","2015","11","","1520","1527","10.3762/bjoc.11.166","","","0.71073","MoKα","","0.0642","0.0433","","","0.0891","0.0979","","","","","","1.071","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031516","12.6905","0.0003","18.5911","0.0003","14.3067","0.0004","90","","113.687","0.003","90","","3091.02","0.14","183","2","183","1","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C32 H41 Cl3 N2 -","- C32 H41 Cl3 N2 -","- C128 H164 Cl12 N8 -","4","1","","Grieco, Gabriele; Blacque, Olivier; Berke, Heinz","A facile synthetic route to benzimidazolium salts bearing bulky aromatic N-substituents.","Beilstein journal of organic chemistry","2015","11","","1656","1666","10.3762/bjoc.11.182","","","1.5418","CuKα","","0.085","0.0777","","","0.2073","0.2142","","","","","","1.077","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031517","12.2554","0.0003","4.962","0.0001","15.2826","0.0003","90","","109.783","0.001","90","","874.51","0.03","104","2","104","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H22 N2 O4 -","- C20 H22 N2 O4 -","- C40 H44 N4 O8 -","2","1","","Zhang, Hanmo; Hay, E. Ben; Geib, Stephen J.; Curran, Dennis P.","Fates of imine intermediates in radical cyclizations ofN-sulfonylindoles and ene-sulfonamides","Beilstein Journal of Organic Chemistry","2015","11","","1649","","10.3762/bjoc.11.181","","","1.54178","CuKα","","0.0519","0.0439","","","0.1059","0.1092","","","","","","1.075","","","","has coordinates","157541","2020-10-21","18:00:00",""
"4031535","23.24","0.003","10.341","0.0005","16.06","0.004","90","","130.19","0.03","90","","2948.4","1.6","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C20 H22 F12 N10 P2 Ru -","- C20 H22 F12 N10 P2 Ru -","- C80 H88 F48 N40 P8 Ru4 -","4","0.5","","Chen, Chao; Lu, Chunxin; Zheng, Qing; Ni, Shengliang; Zhang, Min; Chen, Wanzhi","Synthesis and structures of ruthenium-NHC complexes and their catalysis in hydrogen transfer reaction.","Beilstein journal of organic chemistry","2015","11","","1786","1795","10.3762/bjoc.11.194","","","0.71073","MoKα","","0.0617","0.0539","","","0.1465","0.1558","","","","","","1.059","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031536","11.2914","0.0005","12.7244","0.0006","21.4357","0.0011","90","","102.469","0.004","90","","3007.2","0.3","293","2","293","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C16 H20 F12 N8 P2 Ru -","- C16 H20 F12 N8 P2 Ru -","- C64 H80 F48 N32 P8 Ru4 -","4","1","","Chen, Chao; Lu, Chunxin; Zheng, Qing; Ni, Shengliang; Zhang, Min; Chen, Wanzhi","Synthesis and structures of ruthenium-NHC complexes and their catalysis in hydrogen transfer reaction.","Beilstein journal of organic chemistry","2015","11","","1786","1795","10.3762/bjoc.11.194","","","0.71073","MoKα","","0.0913","0.0712","","","0.2121","0.2322","","","","","","1.064","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031537","11.4695","0.0012","13.1322","0.0014","13.7721","0.0014","97.701","0.001","103.213","0.001","94.057","0.001","1990.1","0.4","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C29 H31 F12 N9 O0 P2 Ru -","- C29 H31 F12 N9 P2 Ru -","- C58 H62 F24 N18 P4 Ru2 -","2","1","","Chen, Chao; Lu, Chunxin; Zheng, Qing; Ni, Shengliang; Zhang, Min; Chen, Wanzhi","Synthesis and structures of ruthenium-NHC complexes and their catalysis in hydrogen transfer reaction.","Beilstein journal of organic chemistry","2015","11","","1786","1795","10.3762/bjoc.11.194","","","0.71073","MoKα","","0.0389","0.0373","","","0.0973","0.0984","","","","","","1.053","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031538","9.913","0.0016","12.665","0.002","18.222","0.003","90","","90","","66.96","","2105.2","0.6","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H35 F12 N8 P3 Ru -","- C34 H35 F12 N8 P3 Ru -","- C68 H70 F24 N16 P6 Ru2 -","2","1","","Chen, Chao; Lu, Chunxin; Zheng, Qing; Ni, Shengliang; Zhang, Min; Chen, Wanzhi","Synthesis and structures of ruthenium-NHC complexes and their catalysis in hydrogen transfer reaction.","Beilstein journal of organic chemistry","2015","11","","1786","1795","10.3762/bjoc.11.194","","","0.71073","MoKα","","0.0455","0.0418","","","0.102","0.1049","","","","","","1.05","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031539","10.957","0.0008","22.2567","0.0016","16.8706","0.0011","90","","97.384","0.006","90","","4080.1","0.5","293","2","293","2","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C24 H22 F12 N8 P2 Ru -","- C24 H22 F12 N8 P2 Ru -","- C96 H88 F48 N32 P8 Ru4 -","4","1","","Chen, Chao; Lu, Chunxin; Zheng, Qing; Ni, Shengliang; Zhang, Min; Chen, Wanzhi","Synthesis and structures of ruthenium-NHC complexes and their catalysis in hydrogen transfer reaction.","Beilstein journal of organic chemistry","2015","11","","1786","1795","10.3762/bjoc.11.194","","","0.71073","MoKα","","0.0794","0.0604","","","0.1788","0.1904","","","","","","1.083","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031711","32.848","0.002","9.4827","0.0002","9.8663","0.0002","90","","90","","90","","3073.2","0.2","153","2","153","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H34 Cu N4 O6 -","- C32 H34 Cu N4 O6 -","- C128 H136 Cu4 N16 O24 -","4","1","","Beniazza, Redouane; Bayo, Natalia; Molton, Florian; Duboc, Carole; Massip, Stéphane; McClenaghan, Nathan; Lastécouères, Dominique; Vincent, Jean-Marc","Effective ascorbate-free and photolatent click reactions in water using a photoreducible copper(II)-ethylenediamine precatalyst.","Beilstein journal of organic chemistry","2015","11","","1950","1959","10.3762/bjoc.11.211","","","1.54187","CuKα","","0.0595","0.0553","","","0.1516","0.1566","","","","","","1.088","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4031712","8.3624","0.0002","13.5055","0.0003","14.8586","0.001","76.556","0.005","82.642","0.006","85.677","0.006","1616.87","0.13","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H34 Cu O8 -","- C36 H34 Cu O8 -","- C72 H68 Cu2 O16 -","2","1","","Beniazza, Redouane; Bayo, Natalia; Molton, Florian; Duboc, Carole; Massip, Stéphane; McClenaghan, Nathan; Lastécouères, Dominique; Vincent, Jean-Marc","Effective ascorbate-free and photolatent click reactions in water using a photoreducible copper(II)-ethylenediamine precatalyst.","Beilstein journal of organic chemistry","2015","11","","1950","1959","10.3762/bjoc.11.211","","","1.54187","CuKα","","0.057","0.0478","","","0.1283","0.1595","","","","","","1.054","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00",""
"4031721","14.4632","0.0006","10.7632","0.0005","14.5754","0.0006","90","","105.357","0.0013","90","","2187.94","0.16","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H27 O2 P S -","- C24 H27 O2 P S -","- C96 H108 O8 P4 S4 -","4","1","","Malysheva, Svetlana F.; Artem'ev, Alexander V.; Gusarova, Nina K.; Belogorlova, Nataliya A.; Albanov, Alexander I.; Liu, C. W.; Trofimov, Boris A.","Aerobic addition of secondary phosphine oxides to vinyl sulfides: a shortcut to 1-hydroxy-2-(organosulfanyl)ethyl(diorganyl)phosphine oxides.","Beilstein journal of organic chemistry","2015","11","","1985","1990","10.3762/bjoc.11.214","","","0.71073","MoKα","","0.0901","0.0448","","","0.084","0.1002","","","","","","1.009","","","","has coordinates","173614","2020-10-21","18:00:00",""
"4031742","16.3306","0.0003","10.2549","0.0002","11.1879","0.0002","90","","90","","90","","1873.62","0.06","123","2","123","2","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C20 H29 Cl N2 Ni -","- C20 H29 Cl N2 Ni -","- C80 H116 Cl4 N8 Ni4 -","4","1","","Yau, Johnathon; Hunt, Kaarel E.; McDougall, Laura; Kennedy, Alan R.; Nelson, David J.","Half-sandwich nickel(II) complexes bearing 1,3-di(cycloalkyl)imidazol-2-ylidene ligands.","Beilstein journal of organic chemistry","2015","11","","2171","2178","10.3762/bjoc.11.235","","","0.71073","MoKα","","0.0412","0.0336","","","0.0652","0.0683","","","","","","1.021","","","","has coordinates","173613","2020-10-21","18:00:00",""
"4031743","8.5685","0.0002","13.9639","0.0003","25.1631","0.0006","90","","97.719","0.002","90","","2983.48","0.12","123","2","123","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C32 H53 Cl N2 Ni -","- C32 H53 Cl N2 Ni -","- C128 H212 Cl4 N8 Ni4 -","4","1","","Yau, Johnathon; Hunt, Kaarel E.; McDougall, Laura; Kennedy, Alan R.; Nelson, David J.","Half-sandwich nickel(II) complexes bearing 1,3-di(cycloalkyl)imidazol-2-ylidene ligands.","Beilstein journal of organic chemistry","2015","11","","2171","2178","10.3762/bjoc.11.235","","","1.5418","CuKα","","0.0587","0.0427","","","0.1037","0.1145","","","","","","1.036","","","","has coordinates","173613","2020-10-21","18:00:00",""
"4031800","11.5881","0.0002","12.315","0.0002","19.3155","0.0014","90","","100.473","0.007","90","","2710.5","0.2","93","2","93","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C59 H77 Cl N4 Pd2 -","- C59 H77 Cl N4 Pd2 -","- C118 H154 Cl2 N8 Pd4 -","2","1","","Melvin, Patrick R.; Hazari, Nilay; Lant, Hannah M. C.; Peczak, Ian L.; Shah, Hemali P.","Comparison of the catalytic activity for the Suzuki‒Miyaura reaction of (η5-Cp)Pd(IPr)Cl with (η3-cinnamyl)Pd(IPr)(Cl) and (η3-1-t-Bu-indenyl)Pd(IPr)(Cl)","Beilstein Journal of Organic Chemistry","2015","11","","2476","","10.3762/bjoc.11.269","","","1.54178","CuKα","","0.0218","0.0218","","","0.0555","0.0556","","","","","","1.055","","","","has coordinates","173609","2020-10-21","18:00:00",""
"4031866","9.38","0.004","9.756","0.004","10.518","0.005","94.969","0.006","90.378","0.006","103.743","0.006","931.1","0.7","100","2","100","2","","","","","","","","5","P 1","P 1","1","","","","- C17 H19 Br N2 O6 -","- C17 H19 Br N2 O6 -","- C34 H38 Br2 N4 O12 -","2","2","","Zhang, Ming-Liang; Yue, Deng-Feng; Wang, Zhen-Hua; Luo, Yuan; Xu, Xiao-Ying; Zhang, Xiao-Mei; Yuan, Wei-Cheng","Organocatalytic asymmetric Henry reaction of 1H-pyrrole-2,3-diones with bifunctional amine-thiourea catalysts bearing multiple hydrogen-bond donors.","Beilstein journal of organic chemistry","2016","12","","295","300","10.3762/bjoc.12.31","","","0.71073","MoKα","","0.1035","0.0742","","","0.187","0.2053","","","","","","1.004","","","","has coordinates","181462","2020-10-21","18:00:00",""
"4031973","8.6709","0.0009","12.9435","0.0016","17.587","0.002","90","","90","","90","","1973.8","0.4","120","2","120","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H26 O3 -","- C25 H25 O3 -","- C100 H100 O12 -","4","1","","Cinar, M. Emin; Engelen, Bernward; Panthöfer, Martin; Deiseroth, Hans-Jörg; Schlirf, Jens; Schmittel, Michael","Scope and mechanism of the highly stereoselective metal-mediated domino aldol reactions of enolates with aldehydes.","Beilstein journal of organic chemistry","2016","12","","813","824","10.3762/bjoc.12.80","","","0.71069","MoKα","","0.0537","0.047","","","0.119","0.1243","","","","","","1.048","","","","has coordinates","185004","2020-10-21","18:00:00",""
"4031974","10.032","0.002","18.5","0.004","9.118","0.002","90","","109.47","0.03","90","","1595.5","0.7","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H26 O3 -","- C19 H26 O3 -","- C76 H104 O12 -","4","1","","Cinar, M. Emin; Engelen, Bernward; Panthöfer, Martin; Deiseroth, Hans-Jörg; Schlirf, Jens; Schmittel, Michael","Scope and mechanism of the highly stereoselective metal-mediated domino aldol reactions of enolates with aldehydes.","Beilstein journal of organic chemistry","2016","12","","813","824","10.3762/bjoc.12.80","","","0.71069","MoKα","","0.0709","0.0456","","","0.1225","0.1341","","","","","","1.029","","","","has coordinates","185004","2020-10-21","18:00:00",""
"4031975","11.63996","0.00006","22.90211","0.00013","14.66629","0.00006","90","","92.3283","0.0004","90","","3906.51","0.03","120","1","120","1","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C34 H39 Cl8 N2 P Pd -","- C34 H39 Cl8 N2 P Pd -","- C136 H156 Cl32 N8 P4 Pd4 -","4","1","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","1.54184","CuKα","","0.0364","0.0351","","","0.085","0.0859","","","","","","1.058","","","","has coordinates","185003","2020-10-21","18:00:00",""
"4031976","11.291","0.006","13.841","0.007","21.603","0.01","82.724","0.008","80.839","0.013","87.563","0.012","3305","3","100","2","100","1","","","","","","","","8","P -1","-P 1","2","","","","- C66.5 H72 B2 Cl4 F8 N4 P2 Pd2 -","- C66.5 H72 B2 Cl4 F8 N4 P2 Pd2 -","- C133 H144 B4 Cl8 F16 N8 P4 Pd4 -","2","1","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.0683","0.0465","","","0.1082","0.1188","","","","","","1.024","","","","has coordinates,has disorder","185003","2020-10-21","18:00:00",""
"4031977","12.435","0.005","15.735","0.007","19.553","0.008","89.234","0.011","89.261","0.014","89.37","0.009","3825","3","100","2","100","1","","","","","","","","8","P -1","-P 1","2","","","","- C40 H47 B Cl2 F4 N2 P Rh -","- C40 H47 B Cl2 F4 N2 P Rh -","- C160 H188 B4 Cl8 F16 N8 P4 Rh4 -","4","2","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.0617","0.0399","","","0.0891","0.099","","","","","","1.021","","","","has coordinates,has disorder","185003","2020-10-21","18:00:00",""
"4031978","10.903","0.004","17.768","0.007","24.913","0.009","107.751","0.013","96.045","0.009","96.26","0.013","4520","3","100","2","100","1","","","","","","","","8","P -1","-P 1","2","","","","- C49 H62 B Cl F4 N2 P Rh -","- C49 H62 B Cl F4 N2 P Rh -","- C196 H248 B4 Cl4 F16 N8 P4 Rh4 -","4","2","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.0634","0.0427","","","0.103","0.1155","","","","","","1.029","","","","has coordinates,has disorder","185003","2020-10-21","18:00:00",""
"4031979","12.47669","0.00019","15.7562","0.0002","19.5579","0.0003","89.2424","0.0012","89.4178","0.0012","89.6008","0.0012","3844.17","0.1","120","1","120","1","","","","","","","","8","P -1","-P 1","2","","","","- C40 H47 B Cl2 F4 Ir N2 P -","- C40 H47 B Cl2 F4 Ir N2 P -","- C160 H188 B4 Cl8 F16 Ir4 N8 P4 -","4","2","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.062","0.0511","","","0.1092","0.1132","","","","","","1.196","","","","has coordinates,has disorder","185003","2020-10-21","18:00:00",""
"4031980","10.95376","0.00006","17.76136","0.00011","24.90835","0.00015","107.762","0.0005","95.9466","0.0005","96.1981","0.0005","4540.08","0.05","120","1","120","1","","","","","","","","8","P -1","-P 1","2","","","","- C49 H62 B Cl F4 Ir N2 P -","- C49 H62 B Cl F4 Ir N2 P -","- C196 H248 B4 Cl4 F16 Ir4 N8 P4 -","4","2","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.0549","0.046","","","0.0716","0.0739","","","","","","1.225","","","","has coordinates,has disorder","185003","2020-10-21","18:00:00",""
"4031981","11.539","0.004","11.74","0.004","16.334","0.006","101.867","0.01","93.026","0.007","94.659","0.006","2152.8","1.3","100","2","100","1","","","","","","","","9","P -1","-P 1","2","","","","- C42.5 H52 B Cl3 F4 I Ir N2 P -","- C42 H50 B Cl2 F4 I Ir N2 P -","- C84 H100 B2 Cl4 F8 I2 Ir2 N4 P2 -","2","1","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.02","0.0186","","","0.0463","0.047","","","","","","1.052","","","","has coordinates","185003","2020-10-21","18:00:00",""
"4031982","17.413","0.009","17.673","0.008","19.974","0.01","90","","90","","90","","6147","5","100","2","100","1","","","","","","","","8","P b c a","-P 2ac 2ab","61","","","","- C30 H35 F3 N O3 P Pd S -","- C30 H35 F3 N O3 P Pd S -","- C240 H280 F24 N8 O24 P8 Pd8 S8 -","8","1","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.0569","0.0393","","","0.0765","0.0929","","","","","","1.196","","","","has coordinates","185003","2020-10-21","18:00:00",""
"4031983","12.941","0.005","12.948","0.006","19.111","0.008","90","","106.643","0.01","90","","3068","2","100","2","100","1","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C33 H40 B F4 N P Rh -","- C33 H40 B F4 N P Rh -","- C132 H160 B4 F16 N4 P4 Rh4 -","4","1","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.0288","0.0245","","","0.0596","0.0629","","","","","","1.047","","","","has coordinates","185003","2020-10-21","18:00:00",""
"4031984","13.001","0.006","18.967","0.008","13.378","0.005","90","","94.921","0.009","90","","3287","2","100","2","100","1","","","","","","","","8","P 1 21/n 1","-P 2yn","14","","","","- C34 H40 F3 Ir N O3 P S -","- C34 H40 F3 Ir N O3 P S -","- C136 H160 F12 Ir4 N4 O12 P4 S4 -","4","1","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.0223","0.0181","","","0.0397","0.0412","","","","","","1.047","","","","has coordinates","185003","2020-10-21","18:00:00",""
"4031985","17.335","0.007","9.113","0.004","25.21","0.011","90","","101.562","0.009","90","","3902","3","100","2","100","1","","","","","","","","10","P 1 21/n 1","-P 2yn","14","","","","- C37 H44 Cl3 F3 I Ir N O3 P S -","- C37 H44 Cl3 F3 I Ir N O3 P S -","- C148 H176 Cl12 F12 I4 Ir4 N4 O12 P4 S4 -","4","1","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.0321","0.0252","","","0.059","0.062","","","","","","1.026","","","","has coordinates","185003","2020-10-21","18:00:00",""
"4031986","9.78588","0.00012","14.13707","0.00016","20.6977","0.0003","105.617","0.0011","96.468","0.0011","104.361","0.001","2621.66","0.06","120","1","120","1","","","","","","","","8","P 1","P 1","1","","","","- C37 H40 B Cl2 F4 N P Rh -","- C36.6667 H39.3333 B Cl1.33333 F4 N P Rh -","- C110 H118 B3 Cl4 F12 N3 P3 Rh3 -","3","3","","Vasilenko, Vladislav; Roth, Torsten; Blasius, Clemens K.; Intorp, Sebastian N.; Wadepohl, Hubert; Gade, Lutz H.","A modular approach to neutral P,N-ligands: synthesis and coordination chemistry.","Beilstein journal of organic chemistry","2016","12","","846","853","10.3762/bjoc.12.83","","x-ray","0.71073","MoKα","","0.0542","0.0447","","","0.09","0.0959","","","","","","1.028","","","","has coordinates","185003","2020-10-21","18:00:00",""
"4031990","25.328","0.005","6.6951","0.0013","10.795","0.002","90","","90","","90","","1830.5","0.6","150","2","150","2","","","","","","","","7","P n m a","-P 2ac 2n","62","","","","- C14 H19 B F4 N4 O2 Pd -","- C14 H19 B F4 N4 O2 Pd -","- C56 H76 B4 F16 N16 O8 Pd4 -","4","0.5","","Nishikata, Takashi; Abela, Alexander R.; Huang, Shenlin; Lipshutz, Bruce H.","Cationic Pd(II)-catalyzed C-H activation/cross-coupling reactions at room temperature: synthetic and mechanistic studies.","Beilstein journal of organic chemistry","2016","12","","1040","1064","10.3762/bjoc.12.99","","","0.71073","MoKα","","0.0455","0.0392","","","0.0989","0.101","","","","","","1.345","","","","has coordinates","185005","2020-10-21","18:00:00",""
"4031991","5.8864","0.0003","9.254","0.0006","12.6617","0.0007","104.549","0.002","95.9357","0.0014","105.233","0.0015","633.46","0.06","120","2","120","2","","","","","","","","5","P 1","P 1","1","","","","- C26 H41 N O4 S -","- C26 H41 N O4 S -","- C26 H41 N O4 S -","1","1","","Trost, Barry M.; Ryan, Michael C.; Rao, Meera","Chiral cyclopentadienylruthenium sulfoxide catalysts for asymmetric redox bicycloisomerization.","Beilstein journal of organic chemistry","2016","12","","1136","1152","10.3762/bjoc.12.110","","","1.54184","CuKα","","0.025","0.0249","","","0.0627","0.0628","","","","","","1.079","","","","has coordinates","186266","2020-10-21","18:00:00",""
"4032037","8.8223","0.0005","9.7894","0.0005","17.1881","0.0009","94.4785","0.0019","101.255","0.0019","116.252","0.0017","1282.73","0.12","120","","120","","","","","","","","","6","P -1","-P 1","2","","4-tert-butyl 2-ethyl 5-(4-bromo-3-iodophenyl)-1-ethyl-4-methylpyrrolidine-2,4-dicarboxylate","","- C24 H33 Br I N O5 -","- C24 H33 Br I N O5 -","- C48 H66 Br2 I2 N2 O10 -","2","1","","Mallia, Carl J.; Walter, Gary C.; Baxendale, Ian R.","Flow carbonylation of sterically hindered ortho-substituted iodoarenes.","Beilstein journal of organic chemistry","2016","12","","1503","1511","10.3762/bjoc.12.147","","x-ray","0.71073","MoKα","","0.0398","0.0274","","","0.0557","0.0591","","","","","","1.032","","","","has coordinates","186264","2020-10-21","18:00:00",""
"4032038","7.991","0.0006","19.372","0.0013","11.091","0.0009","90","","127.399","0.008","90","","1364","0.2","198","2","198","2","","","","","","","synthesis","5","P 1 21/c 1","-P 2ybc","14","DM-449","","","- C12 H17 Cl N4 Pd -","- C12 H17 Cl N4 Pd -","- C48 H68 Cl4 N16 Pd4 -","4","1","","Meyer, Dirk; Strassner, Thomas","Methylpalladium complexes with pyrimidine-functionalized N-heterocyclic carbene ligands.","Beilstein journal of organic chemistry","2016","12","","1557","1565","10.3762/bjoc.12.150","","","0.71073","MoKα","","0.0308","0.0203","","","0.0513","0.0542","","","","","","1.146","","","","has coordinates","186265","2020-10-21","18:00:00",""
"4032039","11.055","0.0008","8.05","0.0005","17.92","0.001","90","","102.069","0.006","90","","1559.5","0.18","198","2","198","2","","","","","","","synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 Br Cl N4 Pd -","- C14 H12 Br Cl N4 Pd -","- C56 H48 Br4 Cl4 N16 Pd4 -","4","1","","Meyer, Dirk; Strassner, Thomas","Methylpalladium complexes with pyrimidine-functionalized N-heterocyclic carbene ligands.","Beilstein journal of organic chemistry","2016","12","","1557","1565","10.3762/bjoc.12.150","","","0.71073","MoKα","","0.0574","0.0311","","","0.0605","0.0675","","","","","","1.098","","","","has coordinates","186265","2020-10-21","18:00:00",""
"4032040","9.29","0.0006","20.254","0.002","15.287","0.0006","90","","127.01","0.004","90","","2296.9","0.3","198","2","198","2","","","","","","","synthesis","6","P 1 21/c 1","-P 2ybc","14","","","","- C22 H25 F3 N4 O2 Pd -","- C22 H25 F3 N4 O2 Pd -","- C88 H100 F12 N16 O8 Pd4 -","4","1","","Meyer, Dirk; Strassner, Thomas","Methylpalladium complexes with pyrimidine-functionalized N-heterocyclic carbene ligands.","Beilstein journal of organic chemistry","2016","12","","1557","1565","10.3762/bjoc.12.150","","","0.71073","MoKα","","0.0344","0.0263","","","0.0769","0.0795","","","","","","1.508","","","","has coordinates","186265","2020-10-21","18:00:00",""
"4032041","11.3","0.001","14.4355","0.0013","26.239","0.002","90","","94.704","0.002","90","","4265.7","0.6","100","","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C48 H71 B P2 Pd -","- C48 H71 B P2 Pd -","- C192 H284 B4 P8 Pd4 -","4","1","","Steinhoff, Patrick; Tauchert, Michael E.","A T-shape diphosphinoborane palladium(0) complex.","Beilstein journal of organic chemistry","2016","12","","1573","1576","10.3762/bjoc.12.152","","","0.71073","MoKα","","0.0408","0.0323","","","0.0742","0.0784","","","","","","1.042","","","","has coordinates","186263","2020-10-21","18:00:00",""
"4032042","6.011","0.0004","9.5419","0.0006","31.23","0.003","90","","90","","90","","1791.2","0.2","200","2","200","2","","","","","","","","3","P 21 c n","P -2n 2a","33","","","","- C25 H17 N3 -","- C25 H17 N3 -","- C100 H68 N12 -","4","1","","Ion, Adrian E.; Cristian, Liliana; Voicescu, Mariana; Bangesh, Masroor; Madalan, Augustin M.; Bala, Daniela; Mihailciuc, Constantin; Nica, Simona","Synthesis and properties of fluorescent 4'-azulenyl-functionalized 2,2':6',2″-terpyridines.","Beilstein journal of organic chemistry","2016","12","","1812","1825","10.3762/bjoc.12.171","","","0.71073","MoKα","","0.0859","0.0441","","","0.1008","0.1398","","","","","","1.077","","","","has coordinates","188920","2020-10-21","18:00:00",""
"4032043","15.2019","0.0012","9.6219","0.0008","17.1451","0.0014","90","","101.007","0.001","90","","2461.7","0.3","185","2","185","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C28 H31 N3 O3 -","- C28 H31 N3 O3 -","- C112 H124 N12 O12 -","4","2","","Goldberg, Mariano; Sartakov, Denis; Bats, Jan W.; Bolte, Michael; Göbel, Michael W","A chiral analog of the bicyclic guanidine TBD: synthesis, structure and Brønsted base catalysis.","Beilstein journal of organic chemistry","2016","12","","1870","1876","10.3762/bjoc.12.176","","","0.71073","MoKα","","0.1706","0.0943","","","0.0972","0.1135","","","","","","1.133","","","","has coordinates","190287","2020-10-21","18:00:00",""
"4032044","6.2818","0.0011","18.682","0.005","33.725","0.005","90","","90","","90","","3957.9","1.4","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H18 Cl N O3 -","- C25 H18 Cl N O3 -","- C200 H144 Cl8 N8 O24 -","8","2","","Goldberg, Mariano; Sartakov, Denis; Bats, Jan W.; Bolte, Michael; Göbel, Michael W","A chiral analog of the bicyclic guanidine TBD: synthesis, structure and Brønsted base catalysis.","Beilstein journal of organic chemistry","2016","12","","1870","1876","10.3762/bjoc.12.176","","","0.71073","MoKα","","0.2976","0.153","","","0.2038","0.2666","","","","","","0.978","","","","has coordinates","188919","2020-10-21","18:00:00",""
"4032045","5.7034","0.0005","11.3752","0.0011","29.276","0.002","90","","90","","90","","1899.3","0.3","173","2","173","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C24 H16 Br N O3 -","- C24 H16 Br N O3 -","- C96 H64 Br4 N4 O12 -","4","1","","Goldberg, Mariano; Sartakov, Denis; Bats, Jan W.; Bolte, Michael; Göbel, Michael W","A chiral analog of the bicyclic guanidine TBD: synthesis, structure and Brønsted base catalysis.","Beilstein journal of organic chemistry","2016","12","","1870","1876","10.3762/bjoc.12.176","","","0.71073","MoKα","","0.1305","0.0547","","","0.0886","0.1099","","","","","","0.811","","","","has coordinates","188919","2020-10-21","18:00:00",""
"4032046","8.483","0.002","33.621","0.009","14.525","0.004","90","","98.986","0.003","90","","4091.8","1.8","100","","100","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H16 O2 -","- C19 H16 O2 -","- C228 H192 O24 -","12","3","","Kotha, Sambasivarao; Gunta, Rama","Bridgehead vicinal diallylation of norbornene derivatives and extension to propellane derivatives via ring-closing metathesis.","Beilstein journal of organic chemistry","2016","12","","1877","1883","10.3762/bjoc.12.177","","","0.7107","MoKα","","0.0856","0.065","","","0.1405","0.1544","","","","","","1.092","","","","has coordinates","188921","2020-10-21","18:00:00",""
"4032047","8.108","0.0016","24.504","0.005","9.769","0.002","90","","90","","90","","1940.9","0.7","293","2","293","2","","","","","","","","3","P n a 21","P 2c -2n","33","","","","- C27 H26 O2 -","- C27 H26 O2 -","- C108 H104 O8 -","4","1","","Kotha, Sambasivarao; Gunta, Rama","Bridgehead vicinal diallylation of norbornene derivatives and extension to propellane derivatives via ring-closing metathesis.","Beilstein journal of organic chemistry","2016","12","","1877","1883","10.3762/bjoc.12.177","","","0.71073","MoKα","","0.0528","0.0414","","","0.0883","0.0931","","","","","","0.991","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4032048","14.63","0.007","11.834","0.006","10.513","0.005","90","","90","","90","","1820.1","1.5","150","","150","","","","","","","","","3","P n m a","-P 2ac 2n","62","","","","- C23 H22 O2 -","- C23 H22 O2 -","- C92 H88 O8 -","4","0.5","","Kotha, Sambasivarao; Gunta, Rama","Bridgehead vicinal diallylation of norbornene derivatives and extension to propellane derivatives via ring-closing metathesis.","Beilstein journal of organic chemistry","2016","12","","1877","1883","10.3762/bjoc.12.177","","","0.71075","MoKα","","0.0499","0.0429","","","0.0959","0.1003","","","","","","1.097","","","","has coordinates","188921","2020-10-21","18:00:00",""
"4032049","7.524","0.003","8.498","0.003","12.116","0.005","88.457","0.013","79.09","0.001","79.868","0.012","748.8","0.5","150","","150","","","","","","","","","3","P -1","-P 1","2","","","","- C21 H18 O2 -","- C21 H18 O2 -","- C42 H36 O4 -","2","1","","Kotha, Sambasivarao; Gunta, Rama","Bridgehead vicinal diallylation of norbornene derivatives and extension to propellane derivatives via ring-closing metathesis.","Beilstein journal of organic chemistry","2016","12","","1877","1883","10.3762/bjoc.12.177","","","0.7107","MoKα","","0.068","0.0429","","","0.0905","0.1026","","","","","","0.84","","","","has coordinates","188921","2020-10-21","18:00:00",""
"4032050","21.926","0.002","17.636","0.002","18.914","0.002","90","","93.67","0.003","90","","7298.8","1.3","100","2","100","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C97 H58 Cl2 F4 N6 Zn -","- C97 H58 Cl2 F4 N6 Zn -","- C388 H232 Cl8 F16 N24 Zn4 -","4","0.5","","Etheridge, Forrest S.; Fernando, Roshan J.; Pejić, Sandra; Zeller, Matthias; Sauvé, Geneviève","Synthesis and characterization of fluorinated azadipyrromethene complexes as acceptors for organic photovoltaics.","Beilstein journal of organic chemistry","2016","12","","1925","1938","10.3762/bjoc.12.182","","","1.54178","CuKα","","0.0487","0.0466","","","0.1215","0.1251","","","","","","1.131","","","","has coordinates,has disorder","188917","2020-10-21","18:00:00",""
"4032055","8.9878","0.001","14.6983","0.0018","10.8669","0.0013","90","","90.983","0.003","90","","1435.4","0.3","123","2","123","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C31 H33 Cl N2 O5 -","- C31 H33 Cl N2 O5 -","- C62 H66 Cl2 N4 O10 -","2","1","","Torii, Masahiro; Kato, Kohsuke; Uraguchi, Daisuke; Ooi, Takashi","Chiral ammonium betaine-catalyzed asymmetric Mannich-type reaction of oxindoles.","Beilstein journal of organic chemistry","2016","12","","2099","2103","10.3762/bjoc.12.199","","","0.71075","MoKα","","0.0244","0.0241","","","0.0626","0.0628","","","","","","1.08","","","","has coordinates","198632","2020-10-21","18:00:00",""
"4032060","17.5326","0.0019","20.845","0.002","22.514","0.002","90","","90","","90","","8228.1","1.4","120","2","120","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C40 H39 Br2 N7 O4 S2 -","- C38 H33 Br2 N7 O3 S -","- C304 H264 Br16 N56 O24 S8 -","8","1","","Izmest’ev, Alexei N; Gazieva, Galina A.; Sigay, Natalya V.; Serkov, Sergei A.; Karnoukhova, Valentina A.; Kachala, Vadim V.; Shashkov, Alexander S.; Zanin, Igor E.; Kravchenko, Angelina N.; Makhova, Nina N.","An effective one-pot access to polynuclear dispiroheterocyclic structures comprising pyrrolidinyloxindole and imidazothiazolotriazine moieties via a 1,3-dipolar cycloaddition strategy","Beilstein Journal of Organic Chemistry","2016","12","","2240","","10.3762/bjoc.12.216","","","0.71073","MoKα","","0.0941","0.0466","","","0.1086","0.129","","","","","","1.012","","","","has coordinates","187522","2020-10-21","18:00:00",""
"4032061","10.2603","0.0005","11.415","0.0006","36.6392","0.0019","90","","94.683","0.001","90","","4276.9","0.4","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C45 H45 Br N10 O3 S -","- C45 H45 Br N10 O3 S -","- C180 H180 Br4 N40 O12 S4 -","4","1","","Izmest’ev, Alexei N; Gazieva, Galina A.; Sigay, Natalya V.; Serkov, Sergei A.; Karnoukhova, Valentina A.; Kachala, Vadim V.; Shashkov, Alexander S.; Zanin, Igor E.; Kravchenko, Angelina N.; Makhova, Nina N.","An effective one-pot access to polynuclear dispiroheterocyclic structures comprising pyrrolidinyloxindole and imidazothiazolotriazine moieties via a 1,3-dipolar cycloaddition strategy","Beilstein Journal of Organic Chemistry","2016","12","","2240","","10.3762/bjoc.12.216","","","0.71073","MoKα","","0.0641","0.0564","","","0.1232","0.1261","","","","","","1.161","","","","has coordinates","187523","2020-10-21","18:00:00",""
"4032062","15.7105","0.0006","13.4273","0.0005","15.0819","0.0005","90","","112.995","0.001","90","","2928.71","0.19","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H32 N8 O5 S -","- C30 H32 N8 O5 S -","- C120 H128 N32 O20 S4 -","4","1","","Izmest’ev, Alexei N; Gazieva, Galina A.; Sigay, Natalya V.; Serkov, Sergei A.; Karnoukhova, Valentina A.; Kachala, Vadim V.; Shashkov, Alexander S.; Zanin, Igor E.; Kravchenko, Angelina N.; Makhova, Nina N.","An effective one-pot access to polynuclear dispiroheterocyclic structures comprising pyrrolidinyloxindole and imidazothiazolotriazine moieties via a 1,3-dipolar cycloaddition strategy","Beilstein Journal of Organic Chemistry","2016","12","","2240","","10.3762/bjoc.12.216","","","0.71073","MoKα","","0.0546","0.0394","","","0.0931","0.1022","","","","","","1.018","","","","has coordinates","187524","2020-10-21","18:00:00",""
"4032063","8.9292","0.0003","12.2608","0.0004","15.9631","0.0006","90","","101.183","0.003","90","","1714.44","0.1","150","0.1","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H15 N3 O4 -","- C20 H15 N3 O4 -","- C80 H60 N12 O16 -","4","1","","Efimov, Ilya V.; Shafikov, Marsel Z.; Beliaev, Nikolai A.; Volkova, Natalia N.; Beryozkina, Tetyana V.; Dehaen, Wim; Fan, Zhijin; Grishko, Viktoria V.; Lubec, Gert; Slepukhin, Pavel A.; Bakulev, Vasiliy A.","Combined experimental and theoretical studies of regio- and stereoselectivity in reactions of β-isoxazolyl- and β-imidazolyl enamines with nitrile oxides","Beilstein Journal of Organic Chemistry","2016","12","","2390","","10.3762/bjoc.12.233","","","0.7107","MoKα","","0.0589","0.0453","","","0.1209","0.1333","","","","","","1.008","","","","has coordinates","188485","2020-10-21","18:00:00",""
"4032064","6.52","0.0009","10.4602","0.0005","17.7675","0.0008","90","","90","","90","","1211.75","0.19","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H10 N4 O3 -","- C13 H10 N4 O3 -","- C52 H40 N16 O12 -","4","1","","Efimov, Ilya V.; Shafikov, Marsel Z.; Beliaev, Nikolai A.; Volkova, Natalia N.; Beryozkina, Tetyana V.; Dehaen, Wim; Fan, Zhijin; Grishko, Viktoria V.; Lubec, Gert; Slepukhin, Pavel A.; Bakulev, Vasiliy A.","Combined experimental and theoretical studies of regio- and stereoselectivity in reactions of β-isoxazolyl- and β-imidazolyl enamines with nitrile oxides","Beilstein Journal of Organic Chemistry","2016","12","","2390","","10.3762/bjoc.12.233","","","0.7107","MoKα","","0.0564","0.044","","","0.1098","0.1188","","","","","","1.003","","","","has coordinates","255805","2020-10-21","18:00:00",""
"4032065","8.9596","0.0004","12.5516","0.0003","15.7754","0.0004","90","","100.144","0.003","90","","1746.33","0.1","150","0.1","150","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H16 N2 O4 -","- C21 H16 N2 O4 -","- C84 H64 N8 O16 -","4","1","","Efimov, Ilya V.; Shafikov, Marsel Z.; Beliaev, Nikolai A.; Volkova, Natalia N.; Beryozkina, Tetyana V.; Dehaen, Wim; Fan, Zhijin; Grishko, Viktoria V.; Lubec, Gert; Slepukhin, Pavel A.; Bakulev, Vasiliy A.","Combined experimental and theoretical studies of regio- and stereoselectivity in reactions of β-isoxazolyl- and β-imidazolyl enamines with nitrile oxides","Beilstein Journal of Organic Chemistry","2016","12","","2390","","10.3762/bjoc.12.233","","","0.7107","MoKα","","0.0582","0.0438","","","0.1265","0.1379","","","","","","1.009","","","","has coordinates","188487","2020-10-21","18:00:00",""
"4032066","9.7218","0.0003","14.1376","0.0002","10.2523","0.0002","90","","115.65","0.003","90","","1270.25","0.06","150","2","150","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","1,4,8,11-tetra(prop-2-yn-1-yl)-1,4,8,11-tetraazacyclotetradecane-1,8-diium perchlorate","","- C22 H34 Cl2 N4 O8 -","- C22 H34 Cl2 N4 O8 -","- C44 H68 Cl4 N8 O16 -","2","0.5","","Counsell, Andrew J.; Jones, Angus T.; Todd, Matthew H.; Rutledge, Peter J.","A direct method for the N-tetraalkylation of azamacrocycles","Beilstein Journal of Organic Chemistry","2016","12","","2457","","10.3762/bjoc.12.239","","","1.54178","CuKα","","0.041","0.0343","","","0.0869","0.0909","","","","","","1.058","","","","has coordinates","188573","2020-10-21","18:00:00",""
"4032067","14.325","0.002","12.234","0.002","29.447","0.005","90","","102.398","0.004","90","","5040.3","1.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18.5 H37 N7 O7.5 -","- C18.5 H37 N7 O7.5 -","- C148 H296 N56 O60 -","8","2","","Semakin, Artem N.; Kokuev, Aleksandr O.; Nelyubina, Yulia V.; Sukhorukov, Alexey Yu; Zhmurov, Petr A.; Ioffe, Sema L.; Tartakovsky, Vladimir A.","Construction of bis-, tris- and tetrahydrazones by addition of azoalkenes to amines and ammonia","Beilstein Journal of Organic Chemistry","2016","12","","2471","","10.3762/bjoc.12.241","","","0.71073","MoKα","","0.2222","0.0897","","","0.2017","0.2715","","","","","","1.055","","","","has coordinates,has disorder","188616","2020-10-21","18:00:00",""
"4032068","16.7086","0.0005","21.6694","0.0008","8.223","0.0003","90","","90","","90","","2977.26","0.18","100","","100","","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C46 H90 N2 O38 -","- C46 H42 N2 O38 -","- C92 H84 N4 O76 -","2","0.5","","Koyanagi, Kohei; Takashima, Yoshinori; Nakamura, Takashi; Yamaguchi, Hiroyasu; Harada, Akira","Radical polymerization by a supramolecular catalyst: cyclodextrin with a RAFT reagent","Beilstein Journal of Organic Chemistry","2016","12","","2495","","10.3762/bjoc.12.244","","","0.71075","MoKα","","","0.0761","","","","0.23","","","","","","1.099","","","","has coordinates","188628","2020-10-21","18:00:00",""
"4032069","15.3495","0.0004","15.391","0.0005","17.9894","0.0006","113.338","0.0009","99.5367","0.0011","102.721","0.001","3651.5","0.2","100","","100","","","","","","","","","4","P 1","P 1","1","","","","- C106.5 H214.5 N4.5 O91.5 -","- C106.5 H137.5 N4.5 O91.5 -","- C106.5 H137.5 N4.5 O91.5 -","1","1","","Koyanagi, Kohei; Takashima, Yoshinori; Nakamura, Takashi; Yamaguchi, Hiroyasu; Harada, Akira","Radical polymerization by a supramolecular catalyst: cyclodextrin with a RAFT reagent","Beilstein Journal of Organic Chemistry","2016","12","","2495","","10.3762/bjoc.12.244","","","0.71075","MoKα","","","0.098","","","","0.2779","","","","","","1.046","","","","has coordinates","188629","2020-10-21","18:00:00",""
"4032070","11.7917","0.0005","7.5448","0.0003","17.661","0.0008","90","","101.754","0.002","90","","1538.28","0.11","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","none","6-ethyl-2-(3-phenylsydnon-4-yl)indolizine","","- C18 H15 N3 O2 -","- C18 H15 N3 O2 -","- C72 H60 N12 O8 -","4","1","","Albota, Florin; Caira, Mino R.; Draghici, Constantin; Dumitrascu, Florea; Dumitrescu, Denisa E.","Sydnone C-4 heteroarylation with an indolizine ring via Chichibabin indolizine synthesis","Beilstein Journal of Organic Chemistry","2016","12","","2503","","10.3762/bjoc.12.245","","","0.71073","MoKα","","0.0685","0.0421","","","0.0995","0.112","","","","","","1.016","","","","has coordinates","188651","2020-10-21","18:00:00",""
"4032071","8.9685","0.0005","10.6487","0.0007","11.0785","0.0007","93.48","0.001","95.886","0.001","109.306","0.001","988.21","0.11","173","2","173","2","","","","","","","","4","P -1","-P 1","2","none","Ethyl 8-ethyl-5-methyl-3-[(3-phenylsydnon-4-yl)-oxomethyl]-indolizine-1-carboxylate","","- C23 H21 N3 O5 -","- C23 H21 N3 O5 -","- C46 H42 N6 O10 -","2","1","","Albota, Florin; Caira, Mino R.; Draghici, Constantin; Dumitrascu, Florea; Dumitrescu, Denisa E.","Sydnone C-4 heteroarylation with an indolizine ring via Chichibabin indolizine synthesis","Beilstein Journal of Organic Chemistry","2016","12","","2503","","10.3762/bjoc.12.245","","","0.71073","MoKα","","0.0499","0.039","","","0.0948","0.1014","","","","","","1.045","","","","has coordinates","188652","2020-10-21","18:00:00",""
"4032072","11.0577","0.0009","12.8224","0.001","11.7987","0.001","90","","110.529","0.003","90","","1566.7","0.2","303.4","","303.4","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 O5 -","- C18 H16 O5 -","- C72 H64 O20 -","4","1","","Jung, Youngeun; Singh, Dileep Kumar; Kim, Ikyon","Symmetry-based approach to oligostilbenoids: Rapid entry to viniferifuran, shoreaphenol, malibatol A, and diptoindonesin G","Beilstein Journal of Organic Chemistry","2016","12","","2689","","10.3762/bjoc.12.266","","","0.71073","MoKα","","0.1362","0.0651","","","0.1454","0.1766","","","","","","1.032","","","","has coordinates,has disorder","189079","2020-10-21","18:00:00",""
"4032074","5.6166","0.0002","13.392","0.0005","31.5475","0.0011","90","","90","","90","","2372.92","0.15","110","2","110","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H34 N2 O3 -","- C27 H34 N2 O3 -","- C108 H136 N8 O12 -","4","1","","Weber, Carina; Pusch, Stefan; Schollmeyer, Dieter; Münster-Müller, Sascha; Pütz, Michael; Opatz, Till","Characterization of the synthetic cannabinoid MDMB-CHMCZCA","Beilstein Journal of Organic Chemistry","2016","12","","2808","","10.3762/bjoc.12.279","","","1.54178","CuKα","","0.0923","0.0657","","","0.165","0.2109","","","","","","1.121","","","","has coordinates,has disorder","189317","2020-10-21","18:00:00",""
"4032426","7.5018","0.0012","12.743","0.002","13.473","0.002","65.335","0.004","79.309","0.004","86.703","0.004","1149.8","0.3","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H28 N2 O4 S2 -","- C24 H28 N2 O4 S2 -","- C48 H56 N4 O8 S4 -","2","1","","Suleymanov, Abdusalom A.; Vasilyev, Dmitry V.; Novikov, Valentin V.; Nelyubina, Yulia V.; Perekalin, Dmitry S.","Unpredictable cycloisomerization of 1,11-dien-6-ynes by a common cobalt catalyst","Beilstein Journal of Organic Chemistry","2017","13","","639","","10.3762/bjoc.13.62","","","0.71073","MoKα","","0.1401","0.0822","","","0.1841","0.206","","","","","","1.078","","","","has coordinates","195196","2020-10-21","18:00:00",""
"4032427","9.1158","0.0006","9.4944","0.0007","9.9154","0.0007","61.548","0.001","71.971","0.001","72.698","0.001","705.83","0.09","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H36 N2 O4 S2 -","- C28 H36 N2 O4 S2 -","- C28 H36 N2 O4 S2 -","1","0.5","","Suleymanov, Abdusalom A.; Vasilyev, Dmitry V.; Novikov, Valentin V.; Nelyubina, Yulia V.; Perekalin, Dmitry S.","Unpredictable cycloisomerization of 1,11-dien-6-ynes by a common cobalt catalyst","Beilstein Journal of Organic Chemistry","2017","13","","639","","10.3762/bjoc.13.62","","","0.71073","MoKα","","0.0529","0.0439","","","0.1036","0.1102","","","","","","1.003","","","","has coordinates","195197","2020-10-21","18:00:00",""
"4033275","11.8026","0.0007","8.2761","0.0004","37.697","0.003","90","","90","","90","","3682.2","0.4","","","100","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C21 H23 N O S2 -","- C21 N O S2 -","- C168 N8 O8 S16 -","8","1","","Laura G Sarbu; Lucian G Bahrin; Peter G Jones; Lucian M Birsa; Henning Hopf","[2.2]Paracyclophane derivatives containing tetrathiafulvalene moieties","Beilstein Journal of Organic Chemistry","2015","11","","1917","1921","10.3762/bjoc.11.207","","x-ray","1.54184","CuKα","","0.0548","0.0478","","","0.1116","0.1162","","","","","","1.09","","","","has coordinates","204217","2020-10-21","18:00:00",""
"4033276","7.4723","0.0003","23.1083","0.0008","9.2378","0.0004","90","","93.56","0.003","90","","1592.03","0.11","","","100","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H16 S3 -","- C19 S3 -","- C76 S12 -","4","2","","Laura G Sarbu; Lucian G Bahrin; Peter G Jones; Lucian M Birsa; Henning Hopf","[2.2]Paracyclophane derivatives containing tetrathiafulvalene moieties","Beilstein Journal of Organic Chemistry","2015","11","","1917","1921","10.3762/bjoc.11.207","","x-ray","1.54184","CuKα","","0.0457","0.045","","","0.1203","0.1208","","","","","","1.071","","","","has coordinates","204218","2020-10-21","18:00:00",""
"4033352","10.5231","0.0009","12.4625","0.0011","9.6181","0.0008","90","","107.523","0.002","90","","1202.83","0.18","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","6-Iodo-4,4,8-trimethyl-1,2,3,4-tetrahydroquinolin-2-one","","- C12 H14 I N O -","- C12 H14 I N O -","- C48 H56 I4 N4 O4 -","4","1","","David R Chisholm; Garr-Layy Zhou; Ehmke Pohl; Roy Valentine; Andrew Whiting","Practical synthetic strategies towards lipophilic 6-iodotetrahydroquinolines and -dihydroquinolines","Beilstein Journal of Organic Chemistry","2016","12","","1851","1862","10.3762/bjoc.12.174","","x-ray","0.71073","MoKα","","0.057","0.0532","","","0.1382","0.1426","","","","","","1.04","","","","has coordinates","205249","2020-10-21","18:00:00",""
"4033353","18.006","0.0008","9.8997","0.0004","13.7872","0.0006","90","","107.361","0.002","90","","2345.66","0.18","120","","120","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","6-Iodo-4,4,8-trimethyl-1,2,3,4-tetrahydroquinoline","","- C12 H16 I N -","- C12 H16 I N -","- C96 H128 I8 N8 -","8","2","","David R Chisholm; Garr-Layy Zhou; Ehmke Pohl; Roy Valentine; Andrew Whiting","Practical synthetic strategies towards lipophilic 6-iodotetrahydroquinolines and -dihydroquinolines","Beilstein Journal of Organic Chemistry","2016","12","","1851","1862","10.3762/bjoc.12.174","","x-ray","0.71073","MoKα","","0.0374","0.0279","","","0.059","0.0632","","","","","","1.082","","","","has coordinates","205250","2020-10-21","18:00:00",""
"4033354","8.358","0.0008","15.7426","0.0015","11.7029","0.0011","90","","93.446","0.002","90","","1537","0.3","120","","120","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","6-Iodo-4,4,8-trimethyl-2-(propan-2-yloxy)-3,4-dihydroquinoline","","- C15 H20 I N O -","- C15 H20 I N O -","- C60 H80 I4 N4 O4 -","4","1","","David R Chisholm; Garr-Layy Zhou; Ehmke Pohl; Roy Valentine; Andrew Whiting","Practical synthetic strategies towards lipophilic 6-iodotetrahydroquinolines and -dihydroquinolines","Beilstein Journal of Organic Chemistry","2016","12","","1851","1862","10.3762/bjoc.12.174","","x-ray","0.71073","MoKα","","0.0664","0.0591","","","0.1448","0.1508","","","","","","1.05","","","","has coordinates","205251","2020-10-21","18:00:00",""
"4033355","12.0435","0.0006","11.5154","0.0006","28.6939","0.0014","90","","96.039","0.002","90","","3957.4","0.3","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4-Dimethyl-1-(propan-2-yl)-6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2,3,4-tetrahydroquinoline","","- C20 H32 B N O2 -","- C20 H32 B N O2 -","- C160 H256 B8 N8 O16 -","8","2","","David R Chisholm; Garr-Layy Zhou; Ehmke Pohl; Roy Valentine; Andrew Whiting","Practical synthetic strategies towards lipophilic 6-iodotetrahydroquinolines and -dihydroquinolines","Beilstein Journal of Organic Chemistry","2016","12","","1851","1862","10.3762/bjoc.12.174","","x-ray","0.71073","MoKα","","0.0919","0.06","","","0.1337","0.1484","","","","","","1.039","","","","has coordinates,has disorder","205252","2020-10-21","18:00:00",""
"4033356","12.2051","0.0005","11.3054","0.0005","28.6657","0.0012","90","","95.011","0.002","90","","3940.3","0.3","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","4,4-dimethyl-1-(propan-2-yl)-6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1,4-dihydroquinoline","","- C20 H30 B N O2 -","- C20 H30 B N O2 -","- C160 H240 B8 N8 O16 -","8","2","","David R Chisholm; Garr-Layy Zhou; Ehmke Pohl; Roy Valentine; Andrew Whiting","Practical synthetic strategies towards lipophilic 6-iodotetrahydroquinolines and -dihydroquinolines","Beilstein Journal of Organic Chemistry","2016","12","","1851","1862","10.3762/bjoc.12.174","","x-ray","0.71073","MoKα","","0.089","0.0547","","","0.125","0.1412","","","","","","1.034","","","","has coordinates","205253","2020-10-21","18:00:00",""
"4033357","18.723","0.0004","8.16224","0.0001","17.8772","0.0004","90","","126.024","0.003","90","","2209.58","0.11","120","","120","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","6-Iodo-4,4-dimethyl-1,2,3,4-tetrahydroquinolin-2-one","","- C11 H12 I N O -","- C11 H12 I N O -","- C88 H96 I8 N8 O8 -","8","1","","David R Chisholm; Garr-Layy Zhou; Ehmke Pohl; Roy Valentine; Andrew Whiting","Practical synthetic strategies towards lipophilic 6-iodotetrahydroquinolines and -dihydroquinolines","Beilstein Journal of Organic Chemistry","2016","12","","1851","1862","10.3762/bjoc.12.174","","x-ray","0.71073","MoKα","","0.0233","0.019","","","0.047","0.0486","","","","","","1.088","","","","has coordinates","205254","2020-10-21","18:00:00",""
"4037807","12.2054","0.0005","28.5826","0.0015","20.7771","0.0011","90","","99.232","0.002","90","","7154.5","0.6","150","2","149.98","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H44 I20 N6 -","- C40 H44 I20 N6 -","- C160 H176 I80 N24 -","4","1","","Xu, Xingyu; Huang, Shiqing; Zhang, Zengyu; Cao, Lei; Yan, Xiaoyu","Halogen-bonding-induced diverse aggregation of 4,5-diiodo-1,2,3-triazolium salts with different anions","Beilstein Journal of Organic Chemistry","2020","16","","78","87","10.3762/bjoc.16.10","","","0.71073","MoKα","","0.0673","0.043","","","0.09","0.0997","","","","","","1.012","","","","has coordinates,has disorder","258188","2020-10-21","18:00:00",""
"4037808","23.5982","0.0013","23.5982","0.0013","9.8455","0.0006","90","","90","","90","","5482.7","0.5","200","2","200","","","","","","","","","5","I -4","I -4","82","","","","- C20 H22 Br I2 N3 -","- C20 H22 Br I2 N3 -","- C160 H176 Br8 I16 N24 -","8","1","","Xu, Xingyu; Huang, Shiqing; Zhang, Zengyu; Cao, Lei; Yan, Xiaoyu","Halogen-bonding-induced diverse aggregation of 4,5-diiodo-1,2,3-triazolium salts with different anions","Beilstein Journal of Organic Chemistry","2020","16","","78","87","10.3762/bjoc.16.10","","","0.71073","MoKα","","0.079","0.0542","","","0.1425","0.1553","","","","","","1.074","","","","has coordinates","258188","2020-10-21","18:00:00",""
"4037809","23.9419","0.001","23.9419","0.001","10.1217","0.0003","90","","90","","90","","5801.9","0.4","200","2","200","","","","","","","","","4","P -4 21 c","P -4 2n","114","","","","- C20 H22 I3 N3 -","- C20 H22 I3 N3 -","- C160 H176 I24 N24 -","8","1","","Xu, Xingyu; Huang, Shiqing; Zhang, Zengyu; Cao, Lei; Yan, Xiaoyu","Halogen-bonding-induced diverse aggregation of 4,5-diiodo-1,2,3-triazolium salts with different anions","Beilstein Journal of Organic Chemistry","2020","16","","78","87","10.3762/bjoc.16.10","","","0.71073","MoKα","","0.1114","0.0613","","","0.1361","0.1531","","","","","","1.12","","","","has coordinates","258188","2020-10-21","18:00:00",""
"4037810","32.77","0.004","9.7269","0.0013","23.215","0.003","90","","134.483","0.003","90","","5279.4","1.2","200","2","200","","","","","","","","","5","C 1 2 1","C 2y","5","","","","- C20 H22 Cl I2 N3 -","- C20 H22 Cl I2 N3 -","- C160 H176 Cl8 I16 N24 -","8","2","","Xu, Xingyu; Huang, Shiqing; Zhang, Zengyu; Cao, Lei; Yan, Xiaoyu","Halogen-bonding-induced diverse aggregation of 4,5-diiodo-1,2,3-triazolium salts with different anions","Beilstein Journal of Organic Chemistry","2020","16","","78","87","10.3762/bjoc.16.10","","","0.71073","MoKα","","0.0893","0.0591","","","0.1166","0.1272","","","","","","1.054","","","","has coordinates","258188","2020-10-21","18:00:00",""
"4037811","15.734","0.003","16.15","0.004","18.906","0.004","109.625","0.006","90.918","0.006","118.792","0.005","3872.6","1.5","298","2","297.85","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H22 B F4 I2 N3 -","- C20 H22 B F4 I2 N3 -","- C120 H132 B6 F24 I12 N18 -","6","3","","Xu, Xingyu; Huang, Shiqing; Zhang, Zengyu; Cao, Lei; Yan, Xiaoyu","Halogen-bonding-induced diverse aggregation of 4,5-diiodo-1,2,3-triazolium salts with different anions","Beilstein Journal of Organic Chemistry","2020","16","","78","87","10.3762/bjoc.16.10","","","0.71073","MoKα","","0.1692","0.0921","","","0.2475","0.2991","","","","","","1.045","","","","has coordinates","258188","2020-10-21","18:00:00",""
"4037812","16.791","0.006","28.467","0.011","12.617","0.005","90","","107.753","0.015","90","","5744","4","150","2","150","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C40 H44 I12 N6 -","- C40 H44 I12 N6 -","- C160 H176 I48 N24 -","4","1","","Xu, Xingyu; Huang, Shiqing; Zhang, Zengyu; Cao, Lei; Yan, Xiaoyu","Halogen-bonding-induced diverse aggregation of 4,5-diiodo-1,2,3-triazolium salts with different anions","Beilstein Journal of Organic Chemistry","2020","16","","78","87","10.3762/bjoc.16.10","","","0.71073","MoKα","","0.0394","0.031","","","0.0645","0.0673","","","","","","1.088","","","","has coordinates,has disorder","258188","2020-10-21","18:00:00",""
"4037813","22.3708","0.0019","11.2189","0.0012","22.842","0.002","90","","117.81","0.003","90","","5070.6","0.8","150","2","150","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C22 H22 F3 I2 N3 O2 -","- C22 H22 F3 I2 N3 O2 -","- C176 H176 F24 I16 N24 O16 -","8","2","","Xu, Xingyu; Huang, Shiqing; Zhang, Zengyu; Cao, Lei; Yan, Xiaoyu","Halogen-bonding-induced diverse aggregation of 4,5-diiodo-1,2,3-triazolium salts with different anions","Beilstein Journal of Organic Chemistry","2020","16","","78","87","10.3762/bjoc.16.10","","","0.71073","MoKα","","0.1111","0.0914","","","0.213","0.2216","","","","","","1.132","","","","has coordinates,has disorder","258188","2020-10-21","18:00:00",""
"4037814","18.1509","0.0013","18.7643","0.0013","20.4941","0.0016","90","","92.369","0.002","90","","6974.1","0.9","150","2","149.97","","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C54 H60 B2 Cl8 F8 I4 N8 -","- C54 H60 B2 Cl8 F8 I4 N8 -","- C216 H240 B8 Cl32 F32 I16 N32 -","4","1","","Xu, Xingyu; Huang, Shiqing; Zhang, Zengyu; Cao, Lei; Yan, Xiaoyu","Halogen-bonding-induced diverse aggregation of 4,5-diiodo-1,2,3-triazolium salts with different anions","Beilstein Journal of Organic Chemistry","2020","16","","78","87","10.3762/bjoc.16.10","","","0.71073","MoKα","","0.1121","0.0965","","","0.202","0.2088","","","","","","1.152","","","","has coordinates,has disorder","258188","2020-10-21","18:00:00",""
"4037815","11.9179","0.001","27.124","0.002","8.6997","0.0007","90","","107.515","0.003","90","","2681.9","0.4","150","2","150","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C23 H27 Cl2 I2 N3 O2 -","- C23 H27 Cl2 I2 N3 O2 -","- C92 H108 Cl8 I8 N12 O8 -","4","1","","Xu, Xingyu; Huang, Shiqing; Zhang, Zengyu; Cao, Lei; Yan, Xiaoyu","Halogen-bonding-induced diverse aggregation of 4,5-diiodo-1,2,3-triazolium salts with different anions","Beilstein Journal of Organic Chemistry","2020","16","","78","87","10.3762/bjoc.16.10","","","0.71073","MoKα","","0.0321","0.0258","","","0.0563","0.0582","","","","","","1.117","","","","has coordinates","258188","2020-10-21","18:00:00",""
"4038065","19.9143","0.0008","19.9143","0.0008","19.9143","0.0008","90","","90","","90","","7897.6","0.5","123","2","123","2","","","","","","","","4","P a -3","-P 2ac 2ab 3","205","","","","- C88 H108 B6 O12 -","- C87.999 H107.998 B6 O12 -","- C351.996 H431.99 B24 O48 -","4","0.166667","","Nagase, Mai; Kato, Kenta; Yagi, Akiko; Segawa, Yasutomo; Itami, Kenichiro","Six-fold C‒H borylation of hexa-peri-hexabenzocoronene","Beilstein Journal of Organic Chemistry","2020","16","","391","397","10.3762/bjoc.16.37","","x-ray","0.71073","MoKα","","0.1252","0.0733","","","0.2041","0.2378","","","","","","1.093","","","","has coordinates,has disorder","258194","2020-10-21","18:00:00",""
"4038068","12.4645","0.0005","12.9987","0.0005","16.7305","0.0005","83.723","0.003","73.112","0.003","86.634","0.003","2577.23","0.17","123","2","123","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H28 N2 O Si -","- C22.4 H22.4 N1.6 O0.8 Si0.8 -","- C112 H112 N8 O4 Si4 -","5","2.5","","Dong, Yafang; Sakai, Masahiko; Fuji, Kazuto; Sekine, Kohei; Kuninobu, Yoichiro","Synthesis of six-membered silacycles by borane-catalyzed double sila-Friedel‒Crafts reaction","Beilstein Journal of Organic Chemistry","2020","16","","409","414","10.3762/bjoc.16.39","","x-ray","0.71073","MoKα","","0.1067","0.087","","","0.2284","0.2555","","","","","","1.058","","","","has coordinates","258190","2020-10-21","18:00:00",""
"4038105","14.58","0.006","21.854","0.01","15.012","0.007","90","","94.439","0.008","90","","4769","4","93","","93","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C50 H66 B Cu F4 N6 -","- C50 H66 B Cu F4 N6 -","- C200 H264 B4 Cu4 F16 N24 -","4","1","","Lazreg, Faïma; Vasseur, Marie; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Aerobic synthesis of N-sulfonylamidines mediated by N-heterocyclic carbene copper(I) catalysts","Beilstein Journal of Organic Chemistry","2020","16","","482","491","10.3762/bjoc.16.43","","","0.71075","MoKα","","0.1081","0.0939","","","0.2495","0.2634","","","","","","0.973","","","","has coordinates","258202","2020-10-21","18:00:00",""
"4038106","12.7795","0.0014","14.5381","0.0015","16.8715","0.0019","88.893","0.006","76.742","0.005","67.949","0.005","2820.1","0.5","93","","93","","","","","","","","","7","P -1","-P 1","2","","","","- C55.5 H79 B Cl2 Cu F4 N5 -","- C55.5 H73 B Cl2 Cu F4 N5 -","- C111 H146 B2 Cl4 Cu2 F8 N10 -","2","1","","Lazreg, Faïma; Vasseur, Marie; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Aerobic synthesis of N-sulfonylamidines mediated by N-heterocyclic carbene copper(I) catalysts","Beilstein Journal of Organic Chemistry","2020","16","","482","491","10.3762/bjoc.16.43","","","0.71075","MoKα","","0.1323","0.0757","","","0.1864","0.2153","","","","","","1.044","","","","has coordinates","258202","2020-10-21","18:00:00",""
"4038107","11.568","0.002","14.868","0.002","20.299","0.003","90","","103.248","0.003","90","","3398.4","0.9","93","","93","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C33 H41 Cu F3 N3 O3 S -","- C33 H41 Cu F3 N3 O3 S -","- C132 H164 Cu4 F12 N12 O12 S4 -","4","1","","Lazreg, Faïma; Vasseur, Marie; Slawin, Alexandra M. Z.; Cazin, Catherine S. J.","Aerobic synthesis of N-sulfonylamidines mediated by N-heterocyclic carbene copper(I) catalysts","Beilstein Journal of Organic Chemistry","2020","16","","482","491","10.3762/bjoc.16.43","","","0.71075","MoKα","","0.0495","0.0422","","","0.114","0.1176","","","","","","1.058","","","","has coordinates","258202","2020-10-21","18:00:00",""
"4038140","7.5972","0.0002","23.8844","0.0006","15.6911","0.0003","90","","90.8293","0.001","90","","2846.92","0.12","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C36 H37 O3 P -","- C36 H37 O3 P -","- C144 H148 O12 P4 -","4","1","","Rahman, Md Shafiqur; Yoshikai, Naohiko","Synthesis of triphenylene-fused phosphole oxides via C‒H functionalizations","Beilstein Journal of Organic Chemistry","2020","16","","524","529","10.3762/bjoc.16.48","","","0.71073","MoKα","","0.0788","0.0521","","","0.1011","0.1137","","","","","","1.075","","","","has coordinates","258199","2020-10-21","18:00:00",""
"4038167","33.9498","0.0008","21.4322","0.0005","12.1761","0.0003","90","","100.114","0.002","90","","8721.9","0.4","100","2","100","2","","","","","","","","6","C 1 2 1","C 2y","5","","","","- C44 H65 B F2 N2 Si2 -","- C44 H65 B F2 N2 Si2 -","- C352 H520 B8 F16 N16 Si16 -","8","2","","Shimada, Takahide; Mori, Shigeki; Ishida, Masatoshi; Furuta, Hiroyuki","Regioselectively α- and β-alkynylated BODIPY dyes via gold(I)-catalyzed direct C-H functionalization and their photophysical properties.","Beilstein journal of organic chemistry","2020","16","","587","595","10.3762/bjoc.16.53","","","0.71073","MoKα","","0.0966","0.064","","","0.1419","0.1603","","","","","","1.002","","","","has coordinates","251799","2020-10-21","18:00:00",""
"4038168","19.9534","0.0004","8.04654","0.00017","25.0121","0.0005","90","","101.75","0.002","90","","3931.69","0.14","100","2","100","2","","","","","","","","6","P 1 2/n 1","-P 2yac","13","","","","- C40 H57 B F2 N2 Si2 -","- C40 H57 B F2 N2 Si2 -","- C160 H228 B4 F8 N8 Si8 -","4","1","","Shimada, Takahide; Mori, Shigeki; Ishida, Masatoshi; Furuta, Hiroyuki","Regioselectively α- and β-alkynylated BODIPY dyes via gold(I)-catalyzed direct C-H functionalization and their photophysical properties.","Beilstein journal of organic chemistry","2020","16","","587","595","10.3762/bjoc.16.53","","","0.71073","MoKα","","0.0571","0.0462","","","0.1111","0.1174","","","","","","1.038","","","","has coordinates","251799","2020-10-21","18:00:00",""
"4038201","6.691","0.005","29.13","0.02","14.044","0.012","90","","97.183","0.017","90","","2716","4","103","","103","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C56 H64 B4 Cl4 O8 -","- C56 H64 B4 Cl4 O8 -","- C112 H128 B8 Cl8 O16 -","2","0.5","","Kano, Haruka; Uehara, Keiji; Matsuo, Kyohei; Hayashi, Hironobu; Yamada, Hiroko; Aratani, Naoki","Direct borylation of terrylene and quaterrylene.","Beilstein journal of organic chemistry","2020","16","","621","627","10.3762/bjoc.16.58","","","0.71073","MoKα","","0.259","0.0847","","","0.1476","0.2254","","","","","","0.925","","","","has coordinates","251803","2020-10-21","18:00:00",""
"4038239","11.187","0.006","9.038","0.005","20.928","0.011","90","","97.133","0.017","90","","2100","2","210","","210","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C23 H19 F2 N O4 S -","- C23 H19 F2 N O4 S -","- C92 H76 F8 N4 O16 S4 -","4","1","","Tan, Xing-Fa; Zhang, Fa-Guang; Ma, Jun-An","Asymmetric synthesis of CF<sub>2</sub>-functionalized aziridines by combined strong Brønsted acid catalysis.","Beilstein journal of organic chemistry","2020","16","","638","644","10.3762/bjoc.16.60","","","0.71073","MoKα","","0.0967","0.0525","","","0.1142","0.1388","","","","","","0.98","","","","has coordinates","251800","2020-10-21","18:00:00",""
"4038240","5.5826","0.0008","16.132","0.002","11.8958","0.0013","90","","90.12","0.05","90","","1071.3","0.2","170","","170","","","","","","","","","7","P 1 21 1","P 2yb","4","","","","- C23 H20 Cl F2 N O4 S -","- C23 H20 Cl F2 N O4 S -","- C46 H40 Cl2 F4 N2 O8 S2 -","2","1","","Tan, Xing-Fa; Zhang, Fa-Guang; Ma, Jun-An","Asymmetric synthesis of CF<sub>2</sub>-functionalized aziridines by combined strong Brønsted acid catalysis.","Beilstein journal of organic chemistry","2020","16","","638","644","10.3762/bjoc.16.60","","","0.71073","MoKα","","0.0685","0.0434","","","0.0836","0.0982","","","","","","1.035","","","","has coordinates","251800","2020-10-21","18:00:00",""
"4038255","5.95332","0.00014","10.881","0.0002","13.1778","0.0003","113.8","0.002","90.4964","0.0019","98.6123","0.0018","769.98","0.03","125","","125","","","","","","","","","3","P -1","-P 1","2","","","","- C17 H28 F2 -","- C17 H28 F2 -","- C34 H56 F4 -","2","1","","Fang, Zeguo; Al-Maharik, Nawaf; Kirsch, Peer; Bremer, Matthias; Slawin, Alexandra M. Z.; O'Hagan, David","Synthesis of organic liquid crystals containing selectively fluorinated cyclopropanes.","Beilstein journal of organic chemistry","2020","16","","674","680","10.3762/bjoc.16.65","","","1.54184","CuKα","","0.0522","0.0488","","","0.2293","0.242","","","","","","1.162","","","","has coordinates","251798","2020-10-21","18:00:00",""
"4038256","17.274","0.004","7.4408","0.0015","27.913","0.006","90","","100.62","0.03","90","","3526.3","1.4","150","2","150","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C29 H14 O2 -","- C29 H14 O2 -","- C232 H112 O16 -","8","2","","Yakiyama, Yumi; Hishikawa, Shota; Sakurai, Hidehiro","Synthesis of C<sub>70</sub>-fragment buckybowls bearing alkoxy substituents.","Beilstein journal of organic chemistry","2020","16","","681","690","10.3762/bjoc.16.66","","","0.71073","MoKα","","0.3593","0.1217","","","0.1498","0.2096","","","","","","1","","","","has coordinates","251802","2020-10-21","18:00:00",""
"4038257","17.382","0.004","7.2895","0.0015","28.978","0.006","90","","90","","90","","3671.7","1.4","150","2","150","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C30 H18 O2 -","- C30 H18 O2 -","- C240 H144 O16 -","8","1","","Yakiyama, Yumi; Hishikawa, Shota; Sakurai, Hidehiro","Synthesis of C<sub>70</sub>-fragment buckybowls bearing alkoxy substituents.","Beilstein journal of organic chemistry","2020","16","","681","690","10.3762/bjoc.16.66","","","0.71073","MoKα","","0.424","0.1319","","","0.2925","0.4008","","","","","","0.903","","","","has coordinates","251802","2020-10-21","18:00:00",""
"4038270","6.3466","0.00018","12.0072","0.0003","24.5409","0.0007","90","","90","","90","","1870.14","0.09","100","1","100","1","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C12 H25 D2 F N O8 P -","- C12 H25 D2 F N O8 P -","- C48 H100 D8 F4 N4 O32 P4 -","4","1","","Kaźmierczak, Marcin; Koroniak, Henryk","Efficient synthesis of dipeptide analogues of α-fluorinated β-aminophosphonates.","Beilstein journal of organic chemistry","2020","16","","756","762","10.3762/bjoc.16.69","","x-ray","0.71073","MoKα","","0.0484","0.0406","","","0.0727","0.0753","","","","","","1.056","","","","has coordinates","251801","2020-10-21","18:00:00",""
"4038273","10.5794","0.0009","12.0811","0.001","31.213","0.003","90.007","0.002","94.017","0.002","90.367","0.002","3979.5","0.6","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","9-((10,20-dihexyl-15-phenylporphyrinato-5-yl)ethynyl)zinc(II)-10-((10,20-dihexyl-15-phenylporphyrinato-5-yl)ethynyl) nickel(II) triptycene","","- C100 H90 N8 Ni Zn -","- C100 H90 N8 Ni Zn -","- C200 H180 N16 Ni2 Zn2 -","2","1","","Locke, Gemma M.; Flanagan, Keith J.; Senge, Mathias O.","Towards triptycene functionalization and triptycene-linked porphyrin arrays.","Beilstein journal of organic chemistry","2020","16","","763","777","10.3762/bjoc.16.70","","x-ray","0.71073","MoKα","","0.092","0.0695","","","0.1631","0.1797","","","","","","1.053","","","","has coordinates,has disorder","251797","2020-10-21","18:00:00",""
"4038274","10.9626","0.0004","11.864","0.0004","12.8821","0.0005","90.244","0.002","93.352","0.002","98.157","0.002","1655.53","0.1","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","9-[(Triisopropylsilyl)ethynyl]-10-[(trimethylsilyl)ethynyl]-triptycene","","- C18 H21 Si -","- C18 H21 Si -","- C72 H84 Si4 -","4","2","","Locke, Gemma M.; Flanagan, Keith J.; Senge, Mathias O.","Towards triptycene functionalization and triptycene-linked porphyrin arrays.","Beilstein journal of organic chemistry","2020","16","","763","777","10.3762/bjoc.16.70","","x-ray","1.54178","CuKα","","0.0972","0.0808","","","0.236","0.2531","","","","","","1.058","","","","has coordinates,has disorder","251797","2020-10-21","18:00:00",""
"4038400","9.851","0.003","9.897","0.003","12.535","0.004","109.173","0.003","110.356","0.003","94.319","0.003","1057.1","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C26 H18 N4 Se2 -","- C26 H18 N4 Se2 -","- C52 H36 N8 Se4 -","2","1","","Matsumura, Mio; Takahashi, Tsutomu; Yamauchi, Hikari; Sakuma, Shunsuke; Hayashi, Yukako; Hyodo, Tadashi; Obata, Tohru; Yamaguchi, Kentaro; Fujiwara, Yasuyuki; Yasuike, Shuji","Synthesis and anticancer activity of bis(2-arylimidazo[1,2-a]pyridin-3-yl) selenides and diselenides: the copper-catalyzed tandem C‒H selenation of 2-arylimidazo[1,2-a]pyridine with selenium","Beilstein Journal of Organic Chemistry","2020","16","","1075","1083","10.3762/bjoc.16.94","","","0.71073","MoKα","","0.0821","0.0787","","","0.2577","0.2592","","","","","","1.11","","","","has coordinates","258191","2020-10-21","18:00:00",""
"4038401","12.1774","0.0009","13.8146","0.0011","12.5652","0.001","90","","102.665","0.002","90","","2062.4","0.3","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C26 H18 N4 Se -","- C26 H18 N4 Se -","- C104 H72 N16 Se4 -","4","1","","Matsumura, Mio; Takahashi, Tsutomu; Yamauchi, Hikari; Sakuma, Shunsuke; Hayashi, Yukako; Hyodo, Tadashi; Obata, Tohru; Yamaguchi, Kentaro; Fujiwara, Yasuyuki; Yasuike, Shuji","Synthesis and anticancer activity of bis(2-arylimidazo[1,2-a]pyridin-3-yl) selenides and diselenides: the copper-catalyzed tandem C‒H selenation of 2-arylimidazo[1,2-a]pyridine with selenium","Beilstein Journal of Organic Chemistry","2020","16","","1075","1083","10.3762/bjoc.16.94","","","1.54178","CuKα","","0.0237","0.0226","","","0.0594","0.0603","","","","","","1.05","","","","has coordinates","258191","2020-10-21","18:00:00",""
"4038412","20.6034","0.0008","20.133","0.0008","22.4357","0.0008","90","","91.989","0.001","90","","9300.9","0.6","120","","120","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C90 H98 N8 O33 S8 -","- C90 H98 N8 O33 S8 -","- C360 H392 N32 O132 S32 -","4","1","","Kuznetsova, Svetlana A.; Gak, Alexander S.; Nelyubina, Yulia V.; Larionov, Vladimir A.; Li, Han; North, Michael; Zhereb, Vladimir P.; Smol'yakov, Alexander F.; Dmitrienko, Artem O.; Medvedev, Michael G.; Gerasimov, Igor S.; Saghyan, Ashot S.; Belokon, Yuri N.","The charge-assisted hydrogen-bonded organic framework (CAHOF) self-assembled from the conjugated acid of tetrakis(4-aminophenyl)methane and 2,6-naphthalenedisulfonate as a new class of recyclable Brønsted acid catalysts","Beilstein Journal of Organic Chemistry","2020","16","","1124","1134","10.3762/bjoc.16.99","","","0.71073","MoKα","","0.0852","0.0578","","","0.1437","0.1719","","","","","","1.025","","","","has coordinates,has disorder","258197","2020-10-21","18:00:00",""
"4038413","13.416","0.007","13.887","0.007","22.73","0.012","88.564","0.008","87.351","0.008","89.836","0.009","4229","4","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C45 H40 N4 O12 S4 -","- C45 H40 N4 O12 S4 -","- C180 H160 N16 O48 S16 -","4","2","","Kuznetsova, Svetlana A.; Gak, Alexander S.; Nelyubina, Yulia V.; Larionov, Vladimir A.; Li, Han; North, Michael; Zhereb, Vladimir P.; Smol'yakov, Alexander F.; Dmitrienko, Artem O.; Medvedev, Michael G.; Gerasimov, Igor S.; Saghyan, Ashot S.; Belokon, Yuri N.","The charge-assisted hydrogen-bonded organic framework (CAHOF) self-assembled from the conjugated acid of tetrakis(4-aminophenyl)methane and 2,6-naphthalenedisulfonate as a new class of recyclable Brønsted acid catalysts","Beilstein Journal of Organic Chemistry","2020","16","","1124","1134","10.3762/bjoc.16.99","","","0.71073","MoKα","","0.1772","0.104","","","0.2283","0.2786","","","","","","1.081","","","","has coordinates","258197","2020-10-21","18:00:00",""
"4038503","9.5001","0.0003","10.163","0.0003","15.8945","0.0006","101.392","0.003","102.647","0.003","100.795","0.003","1424.6","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H10 N O -","- C12.6667 H10.6667 N0.666667 -","- C76 H64 N4 -","6","3","","Tambe, Shrikant D.; Min, Kwan Hong; Iqbal, Naeem; Cho, Eun Jin","Distinctive reactivity of <i>N</i>-benzylidene-[1,1'-biphenyl]-2-amines under photoredox conditions.","Beilstein journal of organic chemistry","2020","16","","1335","1342","10.3762/bjoc.16.114","","x-ray","1.54184","CuKα","","0.0726","0.065","","","0.1917","0.2008","","","","","","1.081","","","","has coordinates","254025","2020-10-21","18:00:00",""
"4038522","5.258","0.004","8.81","0.006","12.257","0.009","99.991","0.009","98.639","0.008","95.953","0.008","547.9","0.7","100","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C10 H11 N3 S2 -","- C10 H11 N3 S2 -","- C20 H22 N6 S4 -","2","1","","Kang, Gui-Feng; Zhang, Gang","One-pot synthesis of 1,3,5-triazine-2,4-dithione derivatives via three-component reactions","Beilstein Journal of Organic Chemistry","2020","16","","1447","1455","10.3762/bjoc.16.120","","","0.71073","MoKα","","0.0951","0.0898","","","0.2374","0.2394","","","","","","1.181","","","","has coordinates","258196","2020-10-21","18:00:00",""
"4038540","9.928","0.003","7.168","0.002","21.272","0.007","90","","92.812","0.009","90","","1512","0.8","93","","93","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C14 H15 Br F3 N O2 -","- C14 H15 Br F3 N O2 -","- C56 H60 Br4 F12 N4 O8 -","4","2","","Davies, Alyn T.; Greenhalgh, Mark D.; Slawin, Alexandra M. Z.; Smith, Andrew D.","NHC-catalyzed enantioselective synthesis of β-trifluoromethyl-β-hydroxyamides","Beilstein Journal of Organic Chemistry","2020","16","","1572","1578","10.3762/bjoc.16.129","","","0.71075","MoKα","","0.0414","0.0378","","","0.0875","0.106","","","","","","0.874","","","","has coordinates","258193","2020-10-21","18:00:00",""
"4038541","9.5366","0.0005","11.6279","0.0007","14.9396","0.0009","99.002","0.005","108.001","0.005","90.007","0.004","1554.09","0.16","120","","120","","","","","","","","","5","P -1","-P 1","2","","","","- C36 H42 Fe N3 O3 -","- C36 H42 Fe N3 O3 -","- C72 H84 Fe2 N6 O6 -","2","1","","Lagesse, Natalie; Pisciottani, Luca; Douarre, Maxime; Godard, Pascale; Kauffmann, Brice; Martí-Centelles, Vicente; McClenaghan, Nathan D.","Five-component, one-pot synthesis of an electroactive rotaxane comprising a bisferrocene macrocycle","Beilstein Journal of Organic Chemistry","2020","16","","1564","1571","10.3762/bjoc.16.128","","x-ray","1.54184","CuKα","","0.0556","0.0454","","","0.1116","0.118","","","","","","1.041","","","","has coordinates","258200","2020-10-21","18:00:00",""
"4038672","10.0069","0.0003","14.7854","0.0005","16.3253","0.0005","90","","90","","90","","2415.43","0.13","120","","120","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C2.7 H2.7 F0.1 N0.2 O0.3 -","- C2.7 H2.7 F0.1 N0.2 O0.3 -","- C108 H108 F4 N8 O12 -","40","10","","Wang, Yuqing; Wang, Gaigai; Peshkov, Anatoly A.; Yao, Ruwei; Hasan, Muhammad; Zaman, Manzoor; Liu, Chao; Kashtanov, Stepan; Pereshivko, Olga P.; Peshkov, Vsevolod A.","Controlling the stereochemistry in 2-oxo-aldehyde-derived Ugi adducts through the cinchona alkaloid-promoted electrophilic fluorination.","Beilstein journal of organic chemistry","2020","16","","1963","1973","10.3762/bjoc.16.163","","x-ray","1.54178","CuKα","","0.0342","0.0334","","","0.087","0.0883","","","","","","1.101","","","","has coordinates","276325","2022-06-28","14:14:18",""
"4038673","13.199","0.002","11.712","0.002","15.424","0.003","90","","91.56","0.009","90","","2383.5","0.7","120","","120.15","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C27 H27 F N2 O3 -","- C27 H27 F N2 O3 -","- C108 H108 F4 N8 O12 -","4","1","","Wang, Yuqing; Wang, Gaigai; Peshkov, Anatoly A.; Yao, Ruwei; Hasan, Muhammad; Zaman, Manzoor; Liu, Chao; Kashtanov, Stepan; Pereshivko, Olga P.; Peshkov, Vsevolod A.","Controlling the stereochemistry in 2-oxo-aldehyde-derived Ugi adducts through the cinchona alkaloid-promoted electrophilic fluorination.","Beilstein journal of organic chemistry","2020","16","","1963","1973","10.3762/bjoc.16.163","","x-ray","1.54178","CuKα","","0.081","0.0637","","","0.1547","0.1783","","","","","","1.055","","","","has coordinates","256197","2020-10-21","18:00:00",""
"4038715","9.6607","0.0009","11.0178","0.001","17.0785","0.0017","90","","90","","90","","1817.8","0.3","295","2","295","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","Dimethyl (2-hydroxy-2,6-dimethyl-5-nitro-4-phenyltetrahydro-2H-pyran-3-yl)phosphonate","","- C15 H22 N O7 P -","- C15 H22 N O7 P -","- C60 H88 N4 O28 P4 -","4","1","","Reznikov, Alexander N.; Nikerov, Dmitry S.; Sibiryakova, Anastasiya E.; Rybakov, Victor B.; Golovin, Evgeniy V.; Klimochkin, Yuri N.","Convenient access to pyrrolidin-3-ylphosphonic acids and tetrahydro-2H-pyran-3-ylphosphonates with multiple contiguous stereocenters from nonracemic adducts of a Ni(II)-catalyzed Michael reaction","Beilstein Journal of Organic Chemistry","2020","16","","2073","2079","10.3762/bjoc.16.174","","x-ray","1.54184","Cukα","","0.0402","0.0335","","","0.08","0.0835","","","","","","1.026","","","","has coordinates","258203","2020-10-21","18:00:00",""
"4038899","31.5592","0.0013","12.8309","0.0005","8.3107","0.0003","90","","94.379","0.003","90","","3355.5","0.2","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H35 N O7 S8 -","- C28 H35 N O7 S8 -","- C112 H140 N4 O28 S32 -","4","1","","Hupatz, Henrik; Gaedke, Marius; Schröder, Hendrik V; Beerhues, Julia; Valkonen, Arto; Klautzsch, Fabian; Müller, Sebastian; Witte, Felix; Rissanen, Kari; Sarkar, Biprajit; Schalley, Christoph A.","Thermodynamic and electrochemical study of tailor-made crown ethers for redox-switchable (pseudo)rotaxanes","Beilstein Journal of Organic Chemistry","2020","16","","2576","2588","10.3762/bjoc.16.209","","","1.54184","CuKα","","0.0528","0.0377","","","0.0807","0.086","","","","","","1.034","","","","has coordinates","258521","2020-10-21","05:25:51",""
"4038900","19.695","0.004","9.1282","0.0016","21.618","0.004","90","","96.451","0.011","90","","3861.9","1.3","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C46 H46 N2 O12 -","- C46 H46 N2 O12 -","- C184 H184 N8 O48 -","4","2","","Hupatz, Henrik; Gaedke, Marius; Schröder, Hendrik V; Beerhues, Julia; Valkonen, Arto; Klautzsch, Fabian; Müller, Sebastian; Witte, Felix; Rissanen, Kari; Sarkar, Biprajit; Schalley, Christoph A.","Thermodynamic and electrochemical study of tailor-made crown ethers for redox-switchable (pseudo)rotaxanes","Beilstein Journal of Organic Chemistry","2020","16","","2576","2588","10.3762/bjoc.16.209","","","1.54178","CuKα","","0.0579","0.0449","","","0.0998","0.1064","","","","","","1.031","","","","has coordinates,has disorder","258523","2020-10-21","05:26:23",""
"4038901","13.6717","0.0013","9.8821","0.001","28.639","0.003","90","","90.657","0.004","90","","3869","0.7","103","2","103","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C44 H50 N4 O10 -","- C44 H50 N4 O10 -","- C176 H200 N16 O40 -","4","1","","Hupatz, Henrik; Gaedke, Marius; Schröder, Hendrik V; Beerhues, Julia; Valkonen, Arto; Klautzsch, Fabian; Müller, Sebastian; Witte, Felix; Rissanen, Kari; Sarkar, Biprajit; Schalley, Christoph A.","Thermodynamic and electrochemical study of tailor-made crown ethers for redox-switchable (pseudo)rotaxanes","Beilstein Journal of Organic Chemistry","2020","16","","2576","2588","10.3762/bjoc.16.209","","","0.71073","MoKα","","0.0664","0.0522","","","0.1187","0.1254","","","","","","1.088","","","","has coordinates,has disorder","258524","2020-10-21","05:26:49",""
"4038923","11.0745","0.0008","4.6972","0.0003","15.6995","0.0009","90","","100.785","0.006","90","","802.25","0.09","150","0.1","150","0.1","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","Methyl-4H-thieno[3,2-b]pyrrole-5-carboxylate","","- C8 H7 N O2 S -","- C8 H7 N O2 S -","- C32 H28 N4 O8 S4 -","4","1","","Vogt, Astrid; Henne, Florian; Wetzel, Christoph; Mena-Osteritz, Elena; Bäuerle, Peter","Synthesis and characterization of S,N-heterotetracenes","Beilstein Journal of Organic Chemistry","2020","16","","2636","2644","10.3762/bjoc.16.214","","x-ray","0.71073","MoKα","","0.0513","0.0367","","","0.0757","0.0855","","","","","","1.032","","","","has coordinates","258611","2020-10-27","05:30:33",""
"4038936","7.1372","0.0006","7.2212","0.0005","18.9343","0.0012","89.548","0.005","85.809","0.006","69.902","0.007","913.83","0.12","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H19 N5 O3 S -","- C18 H19 N5 O3 S -","- C36 H38 N10 O6 S2 -","2","1","","Ilkin, Vladimir; Berseneva, Vera; Beryozkina, Tetyana; Glukhareva, Tatiana; Dianova, Lidia; Dehaen, Wim; Seliverstova, Eugenia; Bakulev, Vasiliy","Regioselective synthesis of heterocyclic N-sulfonyl amidines from heteroaromatic thioamides and sulfonyl azides","Beilstein Journal of Organic Chemistry","2020","16","","2937","2947","10.3762/bjoc.16.243","","","0.71073","MoKα","","0.0943","0.0583","","","0.1229","0.1454","","","","","","1.006","","","","has coordinates","259479","2020-12-03","06:09:03",""
"4038937","10.21","0.006","7.242","0.006","26.864","0.015","90","","97.45","0.05","90","","1970","2","295","2","295","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H14 N4 O5 S -","- C17 H14 N4 O5 S -","- C68 H56 N16 O20 S4 -","4","1","","Ilkin, Vladimir; Berseneva, Vera; Beryozkina, Tetyana; Glukhareva, Tatiana; Dianova, Lidia; Dehaen, Wim; Seliverstova, Eugenia; Bakulev, Vasiliy","Regioselective synthesis of heterocyclic N-sulfonyl amidines from heteroaromatic thioamides and sulfonyl azides","Beilstein Journal of Organic Chemistry","2020","16","","2937","2947","10.3762/bjoc.16.243","","","1.54184","CuKα","","0.0544","0.0462","","","0.1285","0.1316","","","","","","1.009","","","","has coordinates","259480","2020-12-03","06:09:31",""
"4038938","9.4172","0.0008","11.4155","0.001","13.0409","0.0009","97.171","0.006","96.461","0.006","109.787","0.008","1290.7","0.2","295","2","295","2","","","","","","","","5","P -1","-P 1","2","","","","- C23 H27 N7 O7 S -","- C23 H27 N7 O7 S -","- C46 H54 N14 O14 S2 -","2","1","","Ilkin, Vladimir; Berseneva, Vera; Beryozkina, Tetyana; Glukhareva, Tatiana; Dianova, Lidia; Dehaen, Wim; Seliverstova, Eugenia; Bakulev, Vasiliy","Regioselective synthesis of heterocyclic N-sulfonyl amidines from heteroaromatic thioamides and sulfonyl azides","Beilstein Journal of Organic Chemistry","2020","16","","2937","2947","10.3762/bjoc.16.243","","","0.71073","MoKα","","0.1325","0.0632","","","0.1537","0.2221","","","","","","1.008","","","","has coordinates","259481","2020-12-03","06:10:07",""
"4038939","17.4426","0.0006","19.3528","0.0008","15.3931","0.0004","90","","96.8","0.001","90","","5159.6","0.3","170","2","170","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C56 H70 Br O10 -","- C56 H70 Br O10 -","- C224 H280 Br4 O40 -","4","1","","Sheng, Xinru; Li, Errui; Huang, Feihe","Construction of pillar[4]arene[1]quinone‒1,10-dibromodecane pseudorotaxanes in solution and in the solid state","Beilstein Journal of Organic Chemistry","2020","16","","2954","2959","10.3762/bjoc.16.245","","","0.71073","MoKα","","0.0705","0.048","","","0.1227","0.135","","","","","","1.046","","","","has coordinates","259482","2020-12-03","06:10:41",""
"4038941","13.2686","0.0003","7.4126","0.0002","13.3406","0.0003","90","","93.271","0.001","90","","1309.97","0.05","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 F4 N S -","- C13 H15 F4 N S -","- C52 H60 F16 N4 S4 -","4","1","","Supranovich, Vyacheslav I.; Dmitriev, Igor A.; Dilman, Alexander D.","Synthesis of tetrafluorinated piperidines from nitrones via a visible-light-promoted annelation reaction","Beilstein Journal of Organic Chemistry","2020","16","","3104","3108","10.3762/bjoc.16.260","","","0.71073","MoKα","","0.0509","0.0364","","","0.0896","0.0984","","","","","","1.023","","","","has coordinates,has disorder","260223","2020-12-30","06:28:54",""
"4038942","13.413","0.0003","7.3746","0.0002","13.884","0.0003","90","","90.257","0.001","90","","1373.33","0.06","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 F4 N O2 -","- C14 H15 F4 N O2 -","- C56 H60 F16 N4 O8 -","4","1","","Supranovich, Vyacheslav I.; Dmitriev, Igor A.; Dilman, Alexander D.","Synthesis of tetrafluorinated piperidines from nitrones via a visible-light-promoted annelation reaction","Beilstein Journal of Organic Chemistry","2020","16","","3104","3108","10.3762/bjoc.16.260","","","0.71073","MoKα","","0.0606","0.0406","","","0.1097","0.1205","","","","","","1.046","","","","has coordinates","260224","2020-12-30","06:29:20",""
"4039019","5.5075","0.0016","5.6395","0.0015","19.524","0.006","90","","93.936","0.009","90","","605","0.3","150","","150","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C12 H15 N O3 S -","- C12 H15 N O3 S -","- C24 H30 N2 O6 S2 -","2","1","","Joyeux, Benjamin; Gamet, Antoine; Casaretto, Nicolas; Nay, Bastien","Asymmetric synthesis of a stereopentade fragment toward latrunculins","Beilstein Journal of Organic Chemistry","2023","19","","428","433","10.3762/bjoc.19.32","","","0.71073","MoKα","","0.1064","0.0832","","","0.2167","0.2346","","","","","","1.078","","","","has coordinates,has disorder","282631","2023-04-14","01:54:22",""