# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-24T10:25:51+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 'Organic & Biomolecular Chemistry') AND volume = 9 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
"7151626","18.124","0.0013","18.124","0.0013","9.8424","0.0008","90","","90","","90","","3233","0.4","273","2","273","2","","","","","","","","4","I 41/a :2","-I 4ad","88","","","","- C16 H18 O4 Se2 -","- C16 H18 O4 Se2 -","- C128 H144 O32 Se16 -","8","0.5","","Tripathi, Santosh K.; Sharma, Sagar; Singh, Harkesh B.; Butcher, Ray J.","2-Phenoxyethanol derived diselenide and related compounds; synthesis of a seven-membered seleninate ester.","Organic & biomolecular chemistry","2011","9","2","581","587","10.1039/C0OB00038H","","","0.71073","MoKα","","0.1","0.0323","","","0.0567","0.0902","","","","","","1.157","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151627","15.814","0.0012","15.1093","0.0014","18.2919","0.0013","90","","93.682","0.009","90","","4361.6","0.6","193","2","193","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H26 O6 Se2 -","- C20 H26 O6 Se2 -","- C160 H208 O48 Se16 -","8","1","","Tripathi, Santosh K.; Sharma, Sagar; Singh, Harkesh B.; Butcher, Ray J.","2-Phenoxyethanol derived diselenide and related compounds; synthesis of a seven-membered seleninate ester.","Organic & biomolecular chemistry","2011","9","2","581","587","10.1039/C0OB00038H","","","0.71073","MoKα","","0.1194","0.0622","","","0.1445","0.1582","","","","","","1.008","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151628","10.8591","0.0003","10.0425","0.0003","17.0542","0.0004","90","","100.888","0.003","90","","1826.32","0.09","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 N2 O2 S -","- C22 H16 N2 O2 S -","- C88 H64 N8 O8 S4 -","4","1","","Bhurruth-Alcor, Yushma; Røst, Therese; Jorgensen, Michael R.; Kontogiorgis, Christos; Skorve, Jon; Cooper, Robert G.; Sheridan, Joseph M.; Hamilton, William D. O.; Heal, Jonathan R.; Berge, Rolf K.; Miller, Andrew D.","Synthesis of novel PPARα/γ dual agonists as potential drugs for the treatment of the metabolic syndrome and diabetes type II designed using a new de novo design program PROTOBUILD.","Organic & biomolecular chemistry","2011","9","4","1169","1188","10.1039/C0OB00146E","","","0.71073","MoKα","","0.0808","0.0438","","","0.1012","0.1155","","","","","","1.04","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151629","18.0309","0.0004","5.88641","0.00015","19.522","0.0004","90","","98.636","0.002","90","","2048.52","0.08","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C26 H18 N2 O2 S -","- C26 H18 N2 O2 S -","- C104 H72 N8 O8 S4 -","4","1","","Bhurruth-Alcor, Yushma; Røst, Therese; Jorgensen, Michael R.; Kontogiorgis, Christos; Skorve, Jon; Cooper, Robert G.; Sheridan, Joseph M.; Hamilton, William D. O.; Heal, Jonathan R.; Berge, Rolf K.; Miller, Andrew D.","Synthesis of novel PPARα/γ dual agonists as potential drugs for the treatment of the metabolic syndrome and diabetes type II designed using a new de novo design program PROTOBUILD.","Organic & biomolecular chemistry","2011","9","4","1169","1188","10.1039/C0OB00146E","","","1.54248","CuKα","","0.0879","0.0404","","","0.0764","0.0869","","","","","","0.867","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151630","8.565","0.004","12.029","0.006","16.76","0.008","90","","91.239","0.01","90","","1726.4","1.4","273","2","273","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C33 H36 Cl3 N3 Ni O5 -","- C33 H36 Cl3 N3 Ni O5 -","- C66 H72 Cl6 N6 Ni2 O10 -","2","1","","Luo, Xiaoyan; Jin, Zhichao; Li, Pengfei; Gao, Jiabin; Yue, Weimin; Liang, Xinmiao; Ye, Jinxing","Catalytic asymmetric Michael addition of α,β-unsaturated aldehydes to Ni(II) complexes of the Schiff base of glycine.","Organic & biomolecular chemistry","2011","9","3","793","801","10.1039/C0OB00221F","","","0.71073","MoKα","","0.1231","0.0793","","","0.2011","0.2399","","","","","","1.016","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151631","7.529","0.002","13.009","0.004","23.237","0.008","90","","90.36","0.006","90","","2275.9","1.2","125","2","125","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C19 H23 Br2 N2 O3 P -","- C19 H23 Br2 N2 O3 P -","- C76 H92 Br8 N8 O12 P4 -","4","2","","Cheng, Ge; Slawin, Alexandra M. Z.; Vautravers, Nicolas R.; André, Pascal; Morris, Russell E.; Samuel, Ifor D. W.; Cole-Hamilton, David","Synthesis of hybrid dendritic molecules with diazaphospholidine oxide grafted at the surface of octavinylsilsesquioxane (OVS).","Organic & biomolecular chemistry","2011","9","4","1189","1200","10.1039/C0OB00297F","","","0.71073","MoKα","","0.1626","0.1516","","","0.3528","0.3628","","","","","","1.131","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151632","14.786","0.003","9.781","0.002","16.323","0.004","90","","101.211","0.004","90","","2315.6","0.9","125","2","125","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C25 H26 I N2 O3 P -","- C25 H26 I N2 O3 P -","- C100 H104 I4 N8 O12 P4 -","4","1","","Cheng, Ge; Slawin, Alexandra M. Z.; Vautravers, Nicolas R.; André, Pascal; Morris, Russell E.; Samuel, Ifor D. W.; Cole-Hamilton, David","Synthesis of hybrid dendritic molecules with diazaphospholidine oxide grafted at the surface of octavinylsilsesquioxane (OVS).","Organic & biomolecular chemistry","2011","9","4","1189","1200","10.1039/C0OB00297F","","","0.71073","MoKα","","0.0871","0.0396","","","0.0629","0.0722","","","","","","0.914","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151633","9.3517","0.0018","16.96","0.003","11.251","0.002","90","","103.824","0.003","90","","1732.8","0.5","125","2","125","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C18 H20 Br N2 O2 P -","- C18 H20 Br N2 O2 P -","- C72 H80 Br4 N8 O8 P4 -","4","1","","Cheng, Ge; Slawin, Alexandra M. Z.; Vautravers, Nicolas R.; André, Pascal; Morris, Russell E.; Samuel, Ifor D. W.; Cole-Hamilton, David","Synthesis of hybrid dendritic molecules with diazaphospholidine oxide grafted at the surface of octavinylsilsesquioxane (OVS).","Organic & biomolecular chemistry","2011","9","4","1189","1200","10.1039/C0OB00297F","","","0.71073","MoKα","","0.1268","0.0821","","","0.2086","0.2893","","","","","","1.092","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151634","5.1216","0.0003","10.4652","0.0006","21.3646","0.0014","90","","95.373","0.002","90","","1140.08","0.12","100","1","100","1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C21 H32 N2 O6 -","- C21 H32 N2 O6 -","- C42 H64 N4 O12 -","2","1","","Bouillère, Francelin; Guillot, Régis; Kouklovsky, Cyrille; Alezra, Valérie","Access to β,γ-diamino acids. Application to the synthesis of 3-deoxyaminostatine.","Organic & biomolecular chemistry","2011","9","2","394","399","10.1039/C0OB00370K","","x-ray","0.71073","MoKα","","0.1255","0.1177","","","0.316","0.3263","","","","","","1.061","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151635","18.7436","0.0005","18.7436","0.0005","13.3951","0.0004","90","","90","","120","","4075.5","0.2","296","2","296","2","","","","","","","","5","P 61","P 61","169","","","","- C20 H20 Cl2 N2 Pd -","- C20 H20 Cl2 N2 Pd -","- C120 H120 Cl12 N12 Pd6 -","6","1","","Grach, Guillaume; Dinut, Aurelia; Marque, Sylvain; Marrot, Jérôme; Gil, Richard; Prim, Damien","Enantioselective Friedel-Crafts alkylation of indole derivatives catalyzed by new Yb(OTf)3-pyridylalkylamine complexes as chiral Lewis acids.","Organic & biomolecular chemistry","2011","9","2","497","503","10.1039/C0OB00461H","","","0.71073","MoKα","","0.0523","0.0447","","","0.1229","0.1294","","","","","","1.109","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151636","13.912","0.003","5.9518","0.0012","21.173","0.004","90","","90","","90","","1753.2","0.6","100","1","100","1","","","","","","","see text","6","P b c a","-P 2ac 2ab","61","","","","- C9 H6 Cl N O S -","- C9 H6 Cl N O S -","- C72 H48 Cl8 N8 O8 S8 -","8","1","","Wisastra, Rosalina; Ghizzoni, Massimo; Maarsingh, Harm; Minnaard, Adriaan J.; Haisma, Hidde J.; Dekker, Frank J.","Isothiazolones; thiol-reactive inhibitors of cysteine protease cathepsin B and histone acetyltransferase PCAF.","Organic & biomolecular chemistry","2011","9","6","1817","1822","10.1039/C0OB00464B","","","0.71073","MoKα","","0.0456","0.036","","","0.0875","0.0937","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151637","17.363","0.019","6.389","0.007","7.471","0.008","90","","95.868","0.018","90","","824.4","1.6","100","1","100","1","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C9 H7 N O S -","- C9 H7 N O S -","- C36 H28 N4 O4 S4 -","4","1","","Wisastra, Rosalina; Ghizzoni, Massimo; Maarsingh, Harm; Minnaard, Adriaan J.; Haisma, Hidde J.; Dekker, Frank J.","Isothiazolones; thiol-reactive inhibitors of cysteine protease cathepsin B and histone acetyltransferase PCAF.","Organic & biomolecular chemistry","2011","9","6","1817","1822","10.1039/C0OB00464B","","","0.71073","MoKα","","0.1081","0.0767","","","0.1824","0.2014","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151638","16.771","0.0016","7.1231","0.001","21.515","0.003","90","","90","","90","","2570.2","0.6","150","2","150","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C15 H11 N S2 -","- C15 H11 N S2 -","- C120 H88 N8 S16 -","8","2","","Galindo, Miguel A.; Hannant, Jennifer; Harrington, Ross W.; Clegg, William; Horrocks, Benjamin R.; Pike, Andrew R.; Houlton, Andrew","Pyrrolyl-, 2-(2-thienyl)pyrrolyl- and 2,5-bis(2-thienyl)pyrrolyl-nucleosides: synthesis, molecular and electronic structure, and redox behaviour of C5-thymidine derivatives.","Organic & biomolecular chemistry","2011","9","5","1555","1564","10.1039/C0OB00466A","","","0.71073","MoKα","","0.0826","0.0554","","","0.1307","0.148","","","","","","1.086","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151639","18.3919","0.0005","16.7137","0.0005","9.28","0.0003","90","","103.914","0.003","90","","2768.94","0.15","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H13 N S2 -","- C16 H13 N S2 -","- C128 H104 N8 S16 -","8","2","","Galindo, Miguel A.; Hannant, Jennifer; Harrington, Ross W.; Clegg, William; Horrocks, Benjamin R.; Pike, Andrew R.; Houlton, Andrew","Pyrrolyl-, 2-(2-thienyl)pyrrolyl- and 2,5-bis(2-thienyl)pyrrolyl-nucleosides: synthesis, molecular and electronic structure, and redox behaviour of C5-thymidine derivatives.","Organic & biomolecular chemistry","2011","9","5","1555","1564","10.1039/C0OB00466A","","","1.54178","CuKα","","0.0535","0.0389","","","0.1038","0.1103","","","","","","1.044","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151640","18.2767","0.0008","5.6221","0.0002","14.5289","0.0006","90","","90","","90","","1492.89","0.1","150","2","150","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C17 H15 N S2 -","- C17 H15 N S2 -","- C68 H60 N4 S8 -","4","1","","Galindo, Miguel A.; Hannant, Jennifer; Harrington, Ross W.; Clegg, William; Horrocks, Benjamin R.; Pike, Andrew R.; Houlton, Andrew","Pyrrolyl-, 2-(2-thienyl)pyrrolyl- and 2,5-bis(2-thienyl)pyrrolyl-nucleosides: synthesis, molecular and electronic structure, and redox behaviour of C5-thymidine derivatives.","Organic & biomolecular chemistry","2011","9","5","1555","1564","10.1039/C0OB00466A","","","0.71073","MoKα","","0.0504","0.0356","","","0.0633","0.0655","","","","","","0.914","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151641","8.0959","0.0004","5.7246","0.0003","22.417","0.0009","90","","95.369","0.004","90","","1034.38","0.09","150","2","150","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H23 N3 O5 S -","- C22 H23 N3 O5 S -","- C44 H46 N6 O10 S2 -","2","1","","Galindo, Miguel A.; Hannant, Jennifer; Harrington, Ross W.; Clegg, William; Horrocks, Benjamin R.; Pike, Andrew R.; Houlton, Andrew","Pyrrolyl-, 2-(2-thienyl)pyrrolyl- and 2,5-bis(2-thienyl)pyrrolyl-nucleosides: synthesis, molecular and electronic structure, and redox behaviour of C5-thymidine derivatives.","Organic & biomolecular chemistry","2011","9","5","1555","1564","10.1039/C0OB00466A","","","1.54178","CuKα","","0.0903","0.0578","","","0.1278","0.1445","","","","","","0.978","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151642","10.158","0.0006","5.7057","0.0003","11.3236","0.0007","90","","111.933","0.007","90","","608.8","0.07","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C4 H8 Cl N -","- C4 H8 Cl N -","- C16 H32 Cl4 N4 -","4","1","","Galindo, Miguel A.; Hannant, Jennifer; Harrington, Ross W.; Clegg, William; Horrocks, Benjamin R.; Pike, Andrew R.; Houlton, Andrew","Pyrrolyl-, 2-(2-thienyl)pyrrolyl- and 2,5-bis(2-thienyl)pyrrolyl-nucleosides: synthesis, molecular and electronic structure, and redox behaviour of C5-thymidine derivatives.","Organic & biomolecular chemistry","2011","9","5","1555","1564","10.1039/C0OB00466A","","","0.71073","MoKα","","0.039","0.0285","","","0.0699","0.0723","","","","","","1.01","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151643","10.019","0.002","6.5258","0.0013","22.94","0.005","90","","101.39","0.03","90","","1470.3","0.5","113","2","113","2","","","","","","","","5","P 1 21 1","P 2yb","4","4-(2, 3-O-isopropylidene-A-D-ribofuransoyl)amino-5-cyano-6- chloropyrimidine","4-(2, 3-O-isopropylidene-Â-D-ribofuransoyl)amino-5-cyano-6-chloropyrimidine","","- C13 H15 Cl N4 O4 -","- C13 H15 Cl N4 O4 -","- C52 H60 Cl4 N16 O16 -","4","2","","Yang, Hao-Zhe; Pan, Mei-Ying; Jiang, Da-Wei; He, Yang","Synthesis of Janus type nucleoside analogues and their preliminary bioactivity.","Organic & biomolecular chemistry","2011","9","5","1516","1522","10.1039/C0OB00495B","","","0.71073","MoKα","","0.0407","0.0372","","","0.0822","0.0854","","","","","","1.02","","","","has coordinates","287926","2023-12-01","07:54:24",""
"7151644","7.4866","0.0002","14.3369","0.0002","17.3851","0.0003","90","","100.017","0.0009","90","","1837.58","0.06","150","2","150","2","","","","","","","synthesized by the authors","6","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 F3 N O3 S -","- C19 H16 F3 N O3 S -","- C76 H64 F12 N4 O12 S4 -","4","1","","Čížková, Martina; Kolivoška, Viliam; Císařová, Ivana; Šaman, David; Pospíšil, Lubomír; Teplý, Filip","Nitrogen heteroaromatic cations by [2+2+2] cycloaddition.","Organic & biomolecular chemistry","2011","9","2","450","462","10.1039/C0OB00507J","","","0.71073","MoKα","","0.0482","0.0393","","","0.1022","0.1099","","","","","","1.044","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151645","12.175","0.0002","10.9843","0.0002","14.5988","0.0002","90","","90","","90","","1952.35","0.05","150","2","150","2","","","","","","","synthesized by the authors","6","P c a 21","P 2c -2ac","29","","","","- C18 H18 F3 N O3 S2 -","- C18 H18 F3 N O3 S2 -","- C72 H72 F12 N4 O12 S8 -","4","1","","Čížková, Martina; Kolivoška, Viliam; Císařová, Ivana; Šaman, David; Pospíšil, Lubomír; Teplý, Filip","Nitrogen heteroaromatic cations by [2+2+2] cycloaddition.","Organic & biomolecular chemistry","2011","9","2","450","462","10.1039/C0OB00507J","","","0.71073","MoKα","","0.0362","0.0333","","","0.0864","0.0893","","","","","","1.041","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151646","23.1671","0.0005","10.5994","0.0002","15.6896","0.0003","90","","92.516","0.0013","90","","3848.98","0.13","150","2","150","2","","","","","","","synthesized by the authors","6","C 1 2/c 1","-C 2yc","15","","","","- C21 H18 F3 N O3 S -","- C21 H18 F3 N O3 S -","- C168 H144 F24 N8 O24 S8 -","8","1","","Čížková, Martina; Kolivoška, Viliam; Císařová, Ivana; Šaman, David; Pospíšil, Lubomír; Teplý, Filip","Nitrogen heteroaromatic cations by [2+2+2] cycloaddition.","Organic & biomolecular chemistry","2011","9","2","450","462","10.1039/C0OB00507J","","","0.71073","MoKα","","0.0512","0.0405","","","0.1031","0.1105","","","","","","1.035","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151647","23.3925","0.0002","6.2169","0.0004","13.0456","0.0008","90","","90","","90","","1897.21","0.17","150","2","150","2","","","","","","","synthesized by the authors","3","P n a 21","P 2c -2n","33","","","","- C12 H8 N2 -","- C12 H8 N2 -","- C96 H64 N16 -","8","2","","Čížková, Martina; Kolivoška, Viliam; Císařová, Ivana; Šaman, David; Pospíšil, Lubomír; Teplý, Filip","Nitrogen heteroaromatic cations by [2+2+2] cycloaddition.","Organic & biomolecular chemistry","2011","9","2","450","462","10.1039/C0OB00507J","","","0.71073","MoKα","","0.0893","0.0517","","","0.1121","0.1337","","","","","","1.068","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151648","7.4977","0.0002","10.5242","0.0002","11.7581","0.0003","81.4639","0.0015","79.5813","0.0013","75.5501","0.0015","878.42","0.04","150","2","150","2","","","","","","","synthesized by the authors","6","P -1","-P 1","2","","","","- C17 H13 F3 N2 O3 S -","- C17 H13 F3 N2 O3 S -","- C34 H26 F6 N4 O6 S2 -","2","1","","Čížková, Martina; Kolivoška, Viliam; Císařová, Ivana; Šaman, David; Pospíšil, Lubomír; Teplý, Filip","Nitrogen heteroaromatic cations by [2+2+2] cycloaddition.","Organic & biomolecular chemistry","2011","9","2","450","462","10.1039/C0OB00507J","","","0.71073","MoKα","","0.0449","0.0363","","","0.1032","0.1114","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151649","10.9379","0.0017","12.55","0.002","31.289","0.005","90","","90","","90","","4295.1","1.2","180","2","180","2","","","","","","","","5","C 2 2 21","C 2c 2","20","DHT-T2","","","- C18 H30 N2 O6 Si -","- C18 H30 N2 O6 Si -","- C144 H240 N16 O48 Si8 -","8","1","","Luo, Qun; Wu, Dayong; Liu, Shixiong; Tang, Daihua; Huang, Yong; Liu, Xinhou; Wang, Fuyi; Wang, Ruiyao; Wu, Gang","The formation of thymidine-based T-tetramers with remarkable structural and metal ion size effects.","Organic & biomolecular chemistry","2011","9","4","1030","1033","10.1039/C0OB00520G","","","0.71073","MoKα","","0.0302","0.027","","","0.0694","0.0705","","","","","","1.027","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151650","11.2213","0.0003","11.0837","0.0002","18.7917","0.0005","90","","100.181","0.001","90","","2300.39","0.1","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H26 N4 O3 -","- C28 H26 N4 O3 -","- C112 H104 N16 O12 -","4","1","","Chanda, Kaushik; Maiti, Barnali; Yellol, Gorakh S.; Chien, Ming-Hsien; Kuo, Min-Liang; Sun, Chung-Ming","Polymer supported synthesis of novel benzoxazole linked benzimidazoles under microwave conditions: In vitro evaluation of VEGFR-3 kinase inhibition activity.","Organic & biomolecular chemistry","2011","9","6","1917","1926","10.1039/C0OB00547A","","","0.71073","MoKα","","0.0844","0.0473","","","0.1126","0.13","","","","","","1.032","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151651","6.4285","0.0004","31.4664","0.0018","7.0702","0.0004","90","","106.517","0.002","90","","1371.16","0.14","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H13 N O3 -","- C17 H13 N O3 -","- C68 H52 N4 O12 -","4","1","","Chen, Guofei; Fu, Chunling; Ma, Shengming","A novel synthesis of oxazolidine-2,4-diones via an efficient fixation of CO2 with 3-aryl-2-alkynamides.","Organic & biomolecular chemistry","2011","9","1","105","110","10.1039/C0OB00550A","","","0.71073","MoKα","","0.0489","0.0411","","","0.0989","0.1038","","","","","","1.057","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151652","23.576","0.003","16.388","0.002","24.599","0.003","90","","91.441","0.002","90","","9501","2","293","2","293","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C104 H86 N4 Nd2 O20 Zn2 -","- C104 H85 N4 Nd2 O20 Zn2 -","- C416 H340 N16 Nd8 O80 Zn8 -","4","1","","Chen, Guofei; Fu, Chunling; Ma, Shengming","A novel synthesis of oxazolidine-2,4-diones via an efficient fixation of CO2 with 3-aryl-2-alkynamides.","Organic & biomolecular chemistry","2011","9","1","105","110","10.1039/C0OB00550A","","","0.71073","MoKα","","0.0894","0.0578","","","0.1281","0.147","","","","","","0.997","","","","has coordinates","205752","2020-10-21","18:00:00",""
"7151653","13.028","0.003","13.163","0.003","15.397","0.003","75.58","0.03","82.38","0.03","83.32","0.03","2525.1","1","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H45 N2 O11 Tb Zn -","- C53 H45 N2 O11 Tb Zn -","- C106 H90 N4 O22 Tb2 Zn2 -","2","1","","Chen, Guofei; Fu, Chunling; Ma, Shengming","A novel synthesis of oxazolidine-2,4-diones via an efficient fixation of CO2 with 3-aryl-2-alkynamides.","Organic & biomolecular chemistry","2011","9","1","105","110","10.1039/C0OB00550A","","","0.71073","MoKα","","0.0586","0.0406","","","0.0955","0.0992","","","","","","0.986","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151654","13.056","0.004","13.146","0.004","15.367","0.005","75.54","0.003","82.406","0.004","83.166","0.004","2521.4","1.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C53 H45 Ho N2 O11 Zn -","- C53 H45 Ho N2 O11 Zn -","- C106 H90 Ho2 N4 O22 Zn2 -","2","1","","Chen, Guofei; Fu, Chunling; Ma, Shengming","A novel synthesis of oxazolidine-2,4-diones via an efficient fixation of CO2 with 3-aryl-2-alkynamides.","Organic & biomolecular chemistry","2011","9","1","105","110","10.1039/C0OB00550A","","","0.71073","MoKα","","0.0657","0.0523","","","0.1415","0.1497","","","","","","1.031","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151655","10.719","0.002","21.494","0.004","26.116","0.005","90","","90.83","0.03","90","","6016","2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C68 H57 N4 O14 Pr Zn2 -","- C68 H57 N4 O14 Pr Zn2 -","- C272 H228 N16 O56 Pr4 Zn8 -","4","1","","Chen, Guofei; Fu, Chunling; Ma, Shengming","A novel synthesis of oxazolidine-2,4-diones via an efficient fixation of CO2 with 3-aryl-2-alkynamides.","Organic & biomolecular chemistry","2011","9","1","105","110","10.1039/C0OB00550A","","","0.71073","MoKα","","0.0973","0.0477","","","0.0916","0.1104","","","","","","0.939","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151656","5.6309","0.001","8.4895","0.0016","14.66","0.003","88.759","0.003","84.82","0.003","73.866","0.003","670.4","0.2","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H15 Br2 N O -","- C14 H15 Br2 N O -","- C28 H30 Br4 N2 O2 -","2","1","","King, Frank D.; Aliev, Abil E.; Caddick, Stephen; Tocher, D. A.","A novel synthesis of (di)-benzazocinones via an endocyclic N-acyliminium ion cyclisation.","Organic & biomolecular chemistry","2011","9","5","1547","1554","10.1039/C0OB00559B","","","0.71073","MoKα","","0.0436","0.0384","","","0.1051","0.1097","","","","","","0.755","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151657","10.9351","0.0014","11.7459","0.0015","24.978","0.003","90","","90","","90","","3208.2","0.7","291","2","291","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","(S)-2-methyl-N-((S)-1,1,1-trifluoro-4-oxo-4-phenylbutan-2-yl) propane-2-sulfinamide","(S)-2-methyl-N-((S)-1,1,1-trifluoro-4-oxo-4-phenylbutan-2-yl) propane-2-sulfinamide","","- C14 H18 F3 N O2 S -","- C14 H18 F3 N O2 S -","- C112 H144 F24 N8 O16 S8 -","8","2","","Mei, Haibo; Xiong, Yiwen; Han, Jianlin; Pan, Yi","A facile process for the asymmetric synthesis of β-trifluoromethylated β-amino ketones via addition of ketone enolates to sulfinylimine.","Organic & biomolecular chemistry","2011","9","5","1402","1406","10.1039/C0OB00586J","","","0.71073","MoKα","","0.0657","0.0348","","","0.0557","0.0592","","","","","","0.98","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151658","10.881","0.007","17.932","0.011","11.015","0.007","90","","104.754","0.01","90","","2078","2","297","2","297","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C24 H29 N O4 -","- C24 H29 N O4 -","- C96 H116 N4 O16 -","4","1","","Ramesh, Veera V. E.; Roy, Arup; Vijayadas, Kuruppanthara N.; Kendhale, Amol M.; Prabhakaran, Panchami; Gonnade, Rajesh; Puranik, Vedavati G.; Sanjayan, Gangadhar J.","Conformationally rigid aromatic amino acids as potential building blocks for abiotic foldamers.","Organic & biomolecular chemistry","2011","9","2","367","369","10.1039/C0OB00593B","","","0.71073","MoKα","","0.1334","0.0912","","","0.2283","0.2556","","","","","","1.063","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151659","11.8387","0.0017","16.585","0.002","19.535","0.003","90","","90","","90","","3835.6","0.9","293","2","293","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","Phthalimide","","","- C21 H14 N2 O7 -","- C21 H11 N2 O7 -","- C168 H88 N16 O56 -","8","1","","Ramesh, Veera V. E.; Roy, Arup; Vijayadas, Kuruppanthara N.; Kendhale, Amol M.; Prabhakaran, Panchami; Gonnade, Rajesh; Puranik, Vedavati G.; Sanjayan, Gangadhar J.","Conformationally rigid aromatic amino acids as potential building blocks for abiotic foldamers.","Organic & biomolecular chemistry","2011","9","2","367","369","10.1039/C0OB00593B","","","0.71073","MoKα","","0.0707","0.0525","","","0.1466","0.1635","","","","","","1.032","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151660","12.27","0.0003","19.6334","0.0007","20.4221","0.0006","75.23","0.002","72.675","0.002","75.364","0.0014","4457.3","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C96 H96 N16 O24 -","- C96 H96 N16 O24 -","- C192 H192 N32 O48 -","2","1","","Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija","Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.","Organic & biomolecular chemistry","2011","9","3","906","914","10.1039/C0OB00602E","","","1.54178","CuKα","","0.1053","0.0748","","","0.2233","0.2492","","","","","","1.392","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151661","11.8003","0.0004","20.6248","0.0007","21.2868","0.0008","110.363","0.002","97.492","0.002","99.82","0.002","4683.8","0.3","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C99 H102 N16 O25 -","- C99 H102 N16 O25 -","- C198 H204 N32 O50 -","2","1","","Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija","Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.","Organic & biomolecular chemistry","2011","9","3","906","914","10.1039/C0OB00602E","","","1.54178","CuKα","","0.1424","0.0829","","","0.2032","0.2343","","","","","","1.37","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151662","11.1398","0.0003","22.0112","0.0006","22.5117","0.0006","113.189","0.002","100.427","0.0016","99.965","0.0011","4804.5","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C103 H110 N16 O25 -","- C103 H110 N16 O25 -","- C206 H220 N32 O50 -","2","1","","Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija","Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.","Organic & biomolecular chemistry","2011","9","3","906","914","10.1039/C0OB00602E","","","1.54178","CuKα","","0.1549","0.0979","","","0.2643","0.3077","","","","","","1.323","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151663","11.8347","0.0003","20.5903","0.0005","22.5132","0.0007","113.258","0.002","95.992","0.002","100.282","0.002","4865.6","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C103 H110 N16 O25 -","- C103 H110 N16 O25 -","- C206 H220 N32 O50 -","2","1","","Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija","Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.","Organic & biomolecular chemistry","2011","9","3","906","914","10.1039/C0OB00602E","","","1.54178","CuKα","","0.1702","0.0946","","","0.2234","0.2682","","","","","","1.217","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151664","11.9965","0.0003","20.2594","0.0005","22.8564","0.0005","114.695","0.001","96.967","0.0009","99.77","0.002","4857.9","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C100 H104 N16 O24 -","- C100 H104 N16 O24 -","- C200 H208 N32 O48 -","2","1","","Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija","Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.","Organic & biomolecular chemistry","2011","9","3","906","914","10.1039/C0OB00602E","","","1.54178","CuKα","","0.1175","0.0675","","","0.1598","0.1812","","","","","","1.12","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151665","12.0137","0.0003","20.275","0.0004","22.8339","0.0004","115.072","0.001","96.578","0.001","99.681","0.002","4857.3","0.19","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C102 H107 N17 O24 -","- C102 H107 N17 O24 -","- C204 H214 N34 O48 -","2","1","","Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija","Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.","Organic & biomolecular chemistry","2011","9","3","906","914","10.1039/C0OB00602E","","","1.54178","CuKα","","0.0951","0.0651","","","0.1754","0.1913","","","","","","1.23","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151666","12.6739","0.0005","20.5874","0.0007","25.8506","0.0009","77.841","0.003","77.976","0.002","74.025","0.002","6257.4","0.4","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C132 H163 N16 O25.5 -","- C132 H160 N16 O25.5 -","- C264 H320 N32 O51 -","2","1","","Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija","Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.","Organic & biomolecular chemistry","2011","9","3","906","914","10.1039/C0OB00602E","","","1.54178","CuKα","","0.2509","0.1458","","","0.3528","0.4282","","","","","","1.283","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7151667","7.753","0.005","8.285","0.005","11.93","0.005","84.628","0.005","76.938","0.005","84.323","0.005","740.8","0.7","293","2","293","2","","","","","","","synthesis as described","5","P -1","-P 1","2","2,5-dichloro-8-formyl-4(4-methoxyphenyl)quinazoline","2,5-dichloro-8-formyl-4(4-methoxyphenyl)quinazoline","","- C16 H10 Cl2 N2 O2 -","- C16 H10 Cl2 N2 O2 -","- C32 H20 Cl4 N4 O4 -","2","1","","Crespo, Abel; Coelho, Alberto; Diz, Paula M.; Fernández, Franco; Novoa de Armas, Hector; Sotelo, Eddy","Convergent assembly of structurally diverse quinazolines.","Organic & biomolecular chemistry","2011","9","2","351","357","10.1039/C0OB00608D","","x-ray","0.71069","MoKα","","0.0899","0.0442","","","0.0985","0.107","","","","","","0.994","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151668","12.789","0.003","26.622","0.006","20.717","0.004","90","","127.862","0.01","90","","5569","2","293","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C56 H60 F12 N2 O10 P2 -","- C56 H60 F12 N2 O10 P2 -","- C224 H240 F48 N8 O40 P8 -","4","1","","Xu, Zhikai; Jiang, Lasheng; Feng, Yahui; Zhang, Suhui; Liang, Jidong; Pan, Shaowu; Yang, Yu; Yang, Dengke; Cai, Yuepeng","One-pot synthesis of donor-acceptor [2]rotaxanes based on cryptand-paraquat recognition motif.","Organic & biomolecular chemistry","2011","9","4","1237","1243","10.1039/C0OB00629G","","","0.71073","MoKα","","0.2569","0.0996","","","0.2747","0.3605","","","","","","0.956","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151669","13.672","0.011","14.541","0.011","16.402","0.012","112.152","0.01","92.063","0.012","104.255","0.012","2897","4","298","2","298","2","","","","","","","","6","P -1","-P 1","2","","","","- C56 H68 F12 N2 O10 P2 -","- C56 H68 F12 N2 O10 P2 -","- C112 H136 F24 N4 O20 P4 -","2","1","","Xu, Zhikai; Jiang, Lasheng; Feng, Yahui; Zhang, Suhui; Liang, Jidong; Pan, Shaowu; Yang, Yu; Yang, Dengke; Cai, Yuepeng","One-pot synthesis of donor-acceptor [2]rotaxanes based on cryptand-paraquat recognition motif.","Organic & biomolecular chemistry","2011","9","4","1237","1243","10.1039/C0OB00629G","","","0.71073","MoKα","","0.3528","0.1022","","","0.2318","0.3432","","","","","","0.949","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151670","13.677","0.003","17.347","0.004","34.994","0.007","90","","106.807","0.007","90","","7948","3","298","2","293","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C72 H94 F12 N2 O11 P2 -","- C72 H94 F12 N2 O11 P2 -","- C288 H376 F48 N8 O44 P8 -","4","1","","Xu, Zhikai; Jiang, Lasheng; Feng, Yahui; Zhang, Suhui; Liang, Jidong; Pan, Shaowu; Yang, Yu; Yang, Dengke; Cai, Yuepeng","One-pot synthesis of donor-acceptor [2]rotaxanes based on cryptand-paraquat recognition motif.","Organic & biomolecular chemistry","2011","9","4","1237","1243","10.1039/C0OB00629G","","","0.71073","MoKα","","0.2465","0.1151","","","0.3135","0.4038","","","","","","1.048","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151671","13.666","0.002","17.343","0.003","34.9","0.005","90","","106.726","0.005","90","","7922","2","298","2","298","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C72 H92 F12 N2 O11 P2 -","- C72 H92 F12 N2 O11 P2 -","- C288 H368 F48 N8 O44 P8 -","4","1","","Xu, Zhikai; Jiang, Lasheng; Feng, Yahui; Zhang, Suhui; Liang, Jidong; Pan, Shaowu; Yang, Yu; Yang, Dengke; Cai, Yuepeng","One-pot synthesis of donor-acceptor [2]rotaxanes based on cryptand-paraquat recognition motif.","Organic & biomolecular chemistry","2011","9","4","1237","1243","10.1039/C0OB00629G","","","0.71073","MoKα","","0.2379","0.161","","","0.4757","0.5147","","","","","","1.717","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151672","6.5189","0.0001","10.7194","0.0002","11.0482","0.0002","65.732","0.001","77.573","0.001","80.693","0.001","684.99","0.02","180","2","180","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H11 Br2 N O5 -","- C11 H11 Br2 N O5 -","- C22 H22 Br4 N2 O10 -","2","1","","Shearman, James W.; Myers, Rebecca M.; Brenton, James D.; Ley, Steven V.","Total syntheses of subereamollines A and B.","Organic & biomolecular chemistry","2011","9","1","62","65","10.1039/C0OB00636J","","","0.71073","MoKα","","0.059","0.0379","","","0.0876","0.0972","","","","","","1.01","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151673","10.9772","0.0001","25.2605","0.0003","10.1567","0.0002","90","","104.6","0.03","90","","2725.4","0.4","180","2","180","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C11 H11 Br2 N O5 -","- C11 H11 Br2 N O5 -","- C88 H88 Br16 N8 O40 -","8","2","","Shearman, James W.; Myers, Rebecca M.; Brenton, James D.; Ley, Steven V.","Total syntheses of subereamollines A and B.","Organic & biomolecular chemistry","2011","9","1","62","65","10.1039/C0OB00636J","","","0.71073","MoKα","","0.0937","0.0471","","","0.0928","0.1063","","","","","","1.014","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151674","8.971","0.0002","10.6189","0.0002","22.6185","0.0006","90","","90","","90","","2154.69","0.08","250","2","250","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C10 H6 Br2 O4 -","- C10 H6 Br2 O4 -","- C80 H48 Br16 O32 -","8","2","","Shearman, James W.; Myers, Rebecca M.; Brenton, James D.; Ley, Steven V.","Total syntheses of subereamollines A and B.","Organic & biomolecular chemistry","2011","9","1","62","65","10.1039/C0OB00636J","","","0.71073","MoKα","","0.0587","0.0462","","","0.1169","0.1354","","","","","","1.074","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151675","20.618","0.003","4.6216","0.0006","16.874","0.002","90","","117.449","0.002","90","","1426.9","0.3","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C13 H20 N2 O5 -","- C13 H20 N2 O5 -","- C52 H80 N8 O20 -","4","0.5","","Zhang, Yagang; Song, Di; Brown, Julius C.; Shimizu, Ken D.","Suppression of background sites in molecularly imprinted polymers via urea-urea monomer aggregation.","Organic & biomolecular chemistry","2011","9","1","120","126","10.1039/C0OB00637H","","","0.71073","MoKα","","0.0517","0.0362","","","0.0888","0.0948","","","","","","0.951","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151676","8.779","0.0002","15.427","0.0004","12.67","0.0004","90","","94.858","0.002","90","","1709.78","0.08","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C20 H14 F3 N O3 -","- C20 H14 F3 N O3 -","- C80 H56 F12 N4 O12 -","4","1","","Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei","Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.","Organic & biomolecular chemistry","2011","9","2","363","366","10.1039/C0OB00644K","","","0.71073","MoKα","","0.0925","0.0589","","","0.1862","0.2306","","","","","","0.863","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151677","7.811","0.0002","8.3322","0.0002","12.4088","0.0004","70.775","0.001","89.288","0.001","78.72","0.001","746.65","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C15 H15 Br N2 O3 -","- C15 H15 Br N2 O3 -","- C30 H30 Br2 N4 O6 -","2","1","","Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei","Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.","Organic & biomolecular chemistry","2011","9","2","363","366","10.1039/C0OB00644K","","","0.71073","MoKα","","0.062","0.0491","","","0.1081","0.1159","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151678","9.8444","0.0004","10.7537","0.0004","17.1394","0.0008","90","","100.088","0.002","90","","1786.39","0.13","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 N2 O3 -","- C21 H20 N2 O3 -","- C84 H80 N8 O12 -","4","1","","Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei","Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.","Organic & biomolecular chemistry","2011","9","2","363","366","10.1039/C0OB00644K","","","0.71073","MoKα","","0.156","0.0611","","","0.1618","0.244","","","","","","0.99","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151679","11.2975","0.0002","15.8036","0.0003","20.145","0.0006","90","","90","","90","","3596.71","0.14","293","2","293","2","","","","","","","","4","P c a b","-P 2bc 2ac","61","","","","- C19 H16 N2 O6 -","- C19 H16 N2 O6 -","- C152 H128 N16 O48 -","8","1","","Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei","Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.","Organic & biomolecular chemistry","2011","9","2","363","366","10.1039/C0OB00644K","","","0.71073","MoKα","","0.0913","0.0543","","","0.1566","0.1938","","","","","","1.076","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151680","7.8329","0.0003","16.6085","0.0006","13.2043","0.0005","90","","101.014","0.002","90","","1686.14","0.11","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 Cl N O4 -","- C19 H16 Cl N O4 -","- C76 H64 Cl4 N4 O16 -","4","1","","Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei","Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.","Organic & biomolecular chemistry","2011","9","2","363","366","10.1039/C0OB00644K","","","0.71073","MoKα","","0.0586","0.0411","","","0.119","0.1432","","","","","","1.164","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151681","9.851","0.002","11.303","0.002","15.868","0.003","82.36","0.03","76.88","0.03","64.54","0.03","1552.4","0.7","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C38 H36 N O7 -","- C38 H36 N O7 -","- C76 H72 N2 O14 -","2","1","","Liu, Jia; Wang, Xi; Sun, Chang-Liang; Li, Bi-Jie; Shi, Zhang-Jie; Wang, Min","New strategy to construct fused/bridged/spiro carbocyclic scaffolds based on the design of novel 6-C synthon precursor.","Organic & biomolecular chemistry","2011","9","5","1572","1577","10.1039/C0OB00660B","","","0.71073","MoKα","","0.0883","0.0775","","","0.1767","0.1831","","","","","","1.211","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151682","12.624","0.003","10.895","0.002","21.852","0.004","90","","104.9","0.03","90","","2904.4","1.1","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C31 H34 O13 -","- C31 H34 O13 -","- C124 H136 O52 -","4","1","","Liu, Jia; Wang, Xi; Sun, Chang-Liang; Li, Bi-Jie; Shi, Zhang-Jie; Wang, Min","New strategy to construct fused/bridged/spiro carbocyclic scaffolds based on the design of novel 6-C synthon precursor.","Organic & biomolecular chemistry","2011","9","5","1572","1577","10.1039/C0OB00660B","","","0.71073","MoKα","","0.1659","0.0649","","","0.0734","0.0871","","","","","","0.99","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151683","9.7745","0.0006","9.7915","0.0004","20.5118","0.0009","90","","90","","90","","1963.12","0.17","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H17 N3 O8 -","- C20 H17 N3 O8 -","- C80 H68 N12 O32 -","4","1","","Sen, Subhabrata; Potti, Venkata R.; Surakanti, Ramu; Murthy, Y. L. N.; Pallepogu, Raghavaiah","Enantioselective synthesis of spirooxoindoles via chiral auxiliary (bicyclic lactam) controlled SNAr reactions.","Organic & biomolecular chemistry","2011","9","2","358","360","10.1039/C0OB00661K","","","0.71073","MoKα","","0.0805","0.0406","","","0.0662","0.0733","","","","","","0.833","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151684","7.471","0.0001","8.305","0.0001","21.194","0.0004","90","","90","","90","","1315.02","0.03","150","2","150","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H12 N2 O3 -","- C16 H12 N2 O3 -","- C64 H48 N8 O12 -","4","1","","Sunderland, Peter T.; Dhami, Archana; Mahon, Mary F.; Jones, Louise A.; Tully, Sophie R.; Lloyd, Matthew D.; Thompson, Andrew S.; Javaid, Hashim; Martin, Niall M. B.; Threadgill, Michael D.","Synthesis of 4-alkyl-, 4-aryl- and 4-arylamino-5-aminoisoquinolin-1-ones and identification of a new PARP-2 selective inhibitor.","Organic & biomolecular chemistry","2011","9","3","881","891","10.1039/C0OB00665C","","","0.71073","MoKα","","0.0725","0.0426","","","0.0893","0.1022","","","","","","1.083","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151685","8.618","0.0004","9.912","0.0004","10.226","0.0005","114.347","0.002","108.553","0.002","100.738","0.002","701.65","0.06","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H11 Br N2 O3 -","- C16 H11 Br N2 O3 -","- C32 H22 Br2 N4 O6 -","2","1","","Sunderland, Peter T.; Dhami, Archana; Mahon, Mary F.; Jones, Louise A.; Tully, Sophie R.; Lloyd, Matthew D.; Thompson, Andrew S.; Javaid, Hashim; Martin, Niall M. B.; Threadgill, Michael D.","Synthesis of 4-alkyl-, 4-aryl- and 4-arylamino-5-aminoisoquinolin-1-ones and identification of a new PARP-2 selective inhibitor.","Organic & biomolecular chemistry","2011","9","3","881","891","10.1039/C0OB00665C","","","0.71073","MoKα","","0.0421","0.0303","","","0.0642","0.068","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151686","13.988","0.0002","10.997","0.0002","16.197","0.0002","90","","95.645","0.001","90","","2479.44","0.07","150","2","150","2","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C32 H24 N2 O4 -","- C32 H23 N2 O4 -","- C128 H92 N8 O16 -","4","1","","Sunderland, Peter T.; Dhami, Archana; Mahon, Mary F.; Jones, Louise A.; Tully, Sophie R.; Lloyd, Matthew D.; Thompson, Andrew S.; Javaid, Hashim; Martin, Niall M. B.; Threadgill, Michael D.","Synthesis of 4-alkyl-, 4-aryl- and 4-arylamino-5-aminoisoquinolin-1-ones and identification of a new PARP-2 selective inhibitor.","Organic & biomolecular chemistry","2011","9","3","881","891","10.1039/C0OB00665C","","","0.71073","MoKα","","0.0836","0.0649","","","0.1729","0.186","","","","","","1.098","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151687","8.2259","0.0012","12.3386","0.0017","9.1136","0.0013","90","","97.552","0.002","90","","917","0.2","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H16 Br N O5 -","- C20 H16 Br N O5 -","- C40 H32 Br2 N2 O10 -","2","1","","Jin, Zhichao; Yu, Feng; Wang, Xiao; Huang, Huicai; Luo, Xiaoyan; Liang, Xinmiao; Ye, Jinxing","A one-pot asymmetric organocatalytic tandem reaction for the synthesis of oxazine derivatives.","Organic & biomolecular chemistry","2011","9","6","1809","1816","10.1039/C0OB00669F","","","0.71073","MoKα","","0.0661","0.0468","","","0.1032","0.1086","","","","","","0.896","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151688","9.6263","0.0013","14.1765","0.0014","16.473","0.002","90","","90","","90","","2248","0.5","100","2","100","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C24 H25 F3 N2 O2 S -","- C24 H25 F3 N2 O2 S -","- C96 H100 F12 N8 O8 S4 -","4","1","","Grellepois, Fabienne; Nonnenmacher, Jean; Lachaud, Fabien; Portella, Charles","Enantiomerically pure 2-aryl(alkyl)-2-trifluoromethylaziridines: synthesis and ring opening with selected O- and N-nucleophiles.","Organic & biomolecular chemistry","2011","9","4","1160","1168","10.1039/C0OB00690D","","x-ray","0.71073","MoKα","","0.0566","0.042","","","0.0978","0.1031","","","","","","1.019","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151689","9.7065","0.0007","9.7065","0.0007","45.227","0.005","90","","90","","90","","4261.1","0.6","293","2","293","2","","","","","","","","6","P 43 21 2","P 4nw 2abw","96","","","","- C21 H20 F5 N O2 S -","- C21 H20 F5 N O2 S -","- C168 H160 F40 N8 O16 S8 -","8","1","","Li, Peng; Liu, Li-Juan; Liu, Jin-Tao","Per(poly)fluoroalkanesulfinamides assisted diastereoselective three-component inverse-electron-demand aza Diels-Alder reaction.","Organic & biomolecular chemistry","2011","9","1","74","77","10.1039/C0OB00699H","","","0.71073","MoKα","","0.1385","0.04","","","0.058","0.0781","","","","","","0.874","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151690","12.1841","0.0015","5.7816","0.0007","24.406","0.003","90","","99.492","0.002","90","","1695.7","0.4","293","2","293","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C14 H11 Cl F7 N O2 S -","- C14 H11 Cl F7 N O2 S -","- C56 H44 Cl4 F28 N4 O8 S4 -","4","1","","Li, Peng; Liu, Li-Juan; Liu, Jin-Tao","Per(poly)fluoroalkanesulfinamides assisted diastereoselective three-component inverse-electron-demand aza Diels-Alder reaction.","Organic & biomolecular chemistry","2011","9","1","74","77","10.1039/C0OB00699H","","","0.71073","MoKα","","0.0885","0.0732","","","0.2257","0.2394","","","","","","1.073","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151691","10.7328","0.001","12.0282","0.001","19.7768","0.0018","90","","90","","90","","2553.1","0.4","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H33 N O9 -","- C25 H33 N O9 -","- C100 H132 N4 O36 -","4","1","","Kurhade, Suresh E.; Mengawade, Tanaji; Bhuniya, Debnath; Palle, Venkata P.; Reddy, D. Srinivasa","Synthesis of novel sugar-lactam conjugates using the Aubé reaction.","Organic & biomolecular chemistry","2011","9","3","744","747","10.1039/C0OB00719F","","","0.71073","MoKα","","0.1458","0.0571","","","0.0866","0.1055","","","","","","0.956","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151692","6.771","0.0003","26.804","0.0015","7.448","0.0003","90","","89.867","0.003","90","","1351.73","0.11","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C14 H12 N2 O4 S -","- C14 H12 N2 O4 S -","- C56 H48 N8 O16 S4 -","4","2","","Jeffs, Laura; Arquier, Damien; Kariuki, Benson; Bethell, Donald; Page, Philip C Bulman; Hutchings, Graham J.","On the enantioselectivity of aziridination of styrene catalysed by copper triflate and copper-exchanged zeolite Y: consequences of the phase behaviour of enantiomeric mixtures of N-arene-sulfonyl-2-phenylaziridines.","Organic & biomolecular chemistry","2011","9","4","1079","1084","10.1039/C0OB00724B","","","0.71073","MoKα","","0.1178","0.0964","","","0.2224","0.235","","","","","","1.062","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151693","13.483","0.0005","7.543","0.0003","14.765","0.0005","90","","114.997","0.002","90","","1360.98","0.09","150","2","150","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C14 H12 N2 O4 S -","- C14 H12 N2 O4 S -","- C56 H48 N8 O16 S4 -","4","1","","Jeffs, Laura; Arquier, Damien; Kariuki, Benson; Bethell, Donald; Page, Philip C Bulman; Hutchings, Graham J.","On the enantioselectivity of aziridination of styrene catalysed by copper triflate and copper-exchanged zeolite Y: consequences of the phase behaviour of enantiomeric mixtures of N-arene-sulfonyl-2-phenylaziridines.","Organic & biomolecular chemistry","2011","9","4","1079","1084","10.1039/C0OB00724B","","","0.71073","MoKα","","0.065","0.045","","","0.0997","0.109","","","","","","1.052","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151694","10.158","0.003","14.069","0.004","17.637","0.004","90","","99.962","0.011","90","","2482.6","1.2","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H31 N3 O7 -","- C21 H31 N3 O7 -","- C84 H124 N12 O28 -","4","1","","Desmarchelier, Alaric; Marrot, Jérôme; Moreau, Xavier; Greck, Christine","Asymmetric organocatalytic Michael-α-amination sequence for the construction of a quaternary stereocenter.","Organic & biomolecular chemistry","2011","9","4","994","997","10.1039/C0OB00751J","","","0.71073","MoKα","","0.0861","0.0659","","","0.1933","0.2158","","","","","","1.216","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151695","23.0916","0.0013","7.3204","0.0004","38.0041","0.0018","90","","97.32","0.003","90","","6371.8","0.6","296","2","296","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H16 N2 O -","- C20 H16 N2 O -","- C320 H256 N32 O16 -","16","2","","Wu, Hung-Chou; Hwang, Long-Chih; Wu, Ming-Jung","A copper-mediated cyclization reaction of hydrazine with enediynones providing pyrazolo[1,5-a]pyridines.","Organic & biomolecular chemistry","2011","9","3","670","672","10.1039/C0OB00756K","","","0.71073","MoKα","","0.0688","0.0454","","","0.1279","0.1535","","","","","","1.041","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151696","14.2593","0.0003","12.1166","0.0003","19.4748","0.0005","90","","101.738","0.001","90","","3294.38","0.14","200","2","200","2","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C38 H42 Cu2 N4 -","- C38 H38 Cu2 N4 -","- C152 H152 Cu8 N16 -","4","1","","Wu, Hung-Chou; Hwang, Long-Chih; Wu, Ming-Jung","A copper-mediated cyclization reaction of hydrazine with enediynones providing pyrazolo[1,5-a]pyridines.","Organic & biomolecular chemistry","2011","9","3","670","672","10.1039/C0OB00756K","","","0.71073","MoKα","","0.058","0.0432","","","0.1097","0.1192","","","","","","1.037","","","","has coordinates,has disorder","180302","2020-10-21","18:00:00",""
"7151697","9.3101","0.0002","9.2508","0.0003","11.242","0.0004","69.333","0.001","84.453","0.001","76.764","0.001","881.72","0.05","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C17 H19 Cl Cu N2 O -","- C17 H19 Cl Cu N2 O -","- C34 H38 Cl2 Cu2 N4 O2 -","2","1","","Wu, Hung-Chou; Hwang, Long-Chih; Wu, Ming-Jung","A copper-mediated cyclization reaction of hydrazine with enediynones providing pyrazolo[1,5-a]pyridines.","Organic & biomolecular chemistry","2011","9","3","670","672","10.1039/C0OB00756K","","","0.71073","MoKα","","0.0866","0.0799","","","0.1958","0.2017","","","","","","1.038","","","","has coordinates","180302","2020-10-21","18:00:00",""
"7151698","6.0102","0.0006","10.0194","0.0009","15.9053","0.0015","81.28","0.002","83.245","0.002","75.899","0.002","914.94","0.15","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C22 H22 O4 -","- C22 H22 O4 -","- C44 H44 O8 -","2","1","","Sada, Mutsumi; Nomura, Kenichi; Matsubara, Seijiro","A tandem reaction of organozinc reagent prepared from palladium-catalyzed umpolung method: diastereoselective formation of cyclohexene derivatives bearing three adjacent stereocenters.","Organic & biomolecular chemistry","2011","9","5","1389","1393","10.1039/C0OB00806K","","","0.71073","MoKα","","0.0625","0.0541","","","0.1829","0.199","","","","","","0.823","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151699","8.894","0.0003","8.467","0.0003","15.2509","0.0006","90","","90","","90","","1148.48","0.07","260","2","260","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C13 H13 N O2 -","- C13 H13 N O2 -","- C52 H52 N4 O8 -","4","1","","Smith, Catherine J.; Smith, Christopher D.; Nikbin, Nikzad; Ley, Steven V.; Baxendale, Ian R.","Flow synthesis of organic azides and the multistep synthesis of imines and amines using a new monolithic triphenylphosphine reagent.","Organic & biomolecular chemistry","2011","9","6","1927","1937","10.1039/C0OB00813C","","","0.71073","MoKα","","0.0399","0.0338","","","0.0851","0.0907","","","","","","1.078","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151700","7.4355","0.0001","8.5948","0.0002","13.7214","0.0003","88.715","0.001","89.784","0.001","68.818","0.001","817.43","0.03","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C7 H3 Br N4 -","- C7 H3 Br N4 -","- C28 H12 Br4 N16 -","4","2","","Smith, Catherine J.; Smith, Christopher D.; Nikbin, Nikzad; Ley, Steven V.; Baxendale, Ian R.","Flow synthesis of organic azides and the multistep synthesis of imines and amines using a new monolithic triphenylphosphine reagent.","Organic & biomolecular chemistry","2011","9","6","1927","1937","10.1039/C0OB00813C","","","0.71073","MoKα","","0.0541","0.0402","","","0.1012","0.1102","","","","","","1.023","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151701","27.8326","0.0007","6.2301","0.0002","11.8916","0.0003","90","","94.99","0.03","90","","2054.19","0.14","180","2","180","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C10 H9 N5 O -","- C10 H9 N5 O -","- C80 H72 N40 O8 -","8","1","","Smith, Catherine J.; Nikbin, Nikzad; Ley, Steven V.; Lange, Heiko; Baxendale, Ian R.","A fully automated, multistep flow synthesis of 5-amino-4-cyano-1,2,3-triazoles.","Organic & biomolecular chemistry","2011","9","6","1938","1947","10.1039/C0OB00815J","","","0.71073","MoKα","","0.0593","0.0465","","","0.1161","0.1257","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151702","10.1129","0.0002","14.736","0.0005","7.3628","0.0002","90","","118.152","0.003","90","","967.43","0.05","180","2","180","2","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C11 H7 N5 -","- C11 H7 N5 -","- C44 H28 N20 -","4","1","","Smith, Catherine J.; Nikbin, Nikzad; Ley, Steven V.; Lange, Heiko; Baxendale, Ian R.","A fully automated, multistep flow synthesis of 5-amino-4-cyano-1,2,3-triazoles.","Organic & biomolecular chemistry","2011","9","6","1938","1947","10.1039/C0OB00815J","","","0.71073","MoKα","","0.036","0.0308","","","0.0702","0.0727","","","","","","1.05","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151703","33.4277","0.0008","6.1102","0.0002","12.4082","0.0003","90","","106.375","0.002","90","","2431.57","0.12","180","2","180","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 H13 N5 -","- C12 H13 N5 -","- C96 H104 N40 -","8","1","","Smith, Catherine J.; Nikbin, Nikzad; Ley, Steven V.; Lange, Heiko; Baxendale, Ian R.","A fully automated, multistep flow synthesis of 5-amino-4-cyano-1,2,3-triazoles.","Organic & biomolecular chemistry","2011","9","6","1938","1947","10.1039/C0OB00815J","","","0.71073","MoKα","","0.0681","0.047","","","0.1327","0.1412","","","","","","1.088","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151704","7.2576","0.0002","8.4262","0.0002","8.8405","0.0002","97.305","0.001","110.101","0.001","90.585","0.001","502.74","0.02","180","2","180","2","","","","","","","","4","P -1","-P 1","2","","","","- C10 H5 Br N6 -","- C10 H5 Br N6 -","- C20 H10 Br2 N12 -","2","1","","Smith, Catherine J.; Nikbin, Nikzad; Ley, Steven V.; Lange, Heiko; Baxendale, Ian R.","A fully automated, multistep flow synthesis of 5-amino-4-cyano-1,2,3-triazoles.","Organic & biomolecular chemistry","2011","9","6","1938","1947","10.1039/C0OB00815J","","","0.71073","MoKα","","0.0401","0.032","","","0.0772","0.0811","","","","","","1.035","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151705","6.9783","0.0003","11.2514","0.0005","14.4801","0.0007","90","","91.389","0.002","90","","1136.58","0.09","296","2","296","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C18 H28 N2 O6 Se2 -","- C18 H28 N2 O6 Se2 -","- C36 H56 N4 O12 Se4 -","2","1","","Bhuyan, Bhaskar J.; Mugesh, Govindasamy","Synthesis, characterization and antioxidant activity of angiotensin converting enzyme inhibitors.","Organic & biomolecular chemistry","2011","9","5","1356","1365","10.1039/C0OB00823K","","","0.71073","MoKα","","0.0587","0.038","","","0.0708","0.0775","","","","","","1.036","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151706","5.3658","0.0011","10.1748","0.0018","10.905","0.002","82.918","0.011","88.385","0.011","78.119","0.012","578.17","0.19","296","2","296","2","","","","","","","","5","P 1","P 1","1","","","","- C21 H36 Br N2 O3 -","- C21 H36 Br N2 O3 -","- C21 H36 Br N2 O3 -","1","1","","Bhuyan, Bhaskar J.; Mugesh, Govindasamy","Synthesis, characterization and antioxidant activity of angiotensin converting enzyme inhibitors.","Organic & biomolecular chemistry","2011","9","5","1356","1365","10.1039/C0OB00823K","","","0.71073","MoKα","","0.1794","0.095","","","0.2661","0.3022","","","","","","0.921","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151707","5.7334","0.0009","7.899","0.0012","47.642","0.007","90","","90","","90","","2157.6","0.6","293","2","293","2","","","","","","","","4","P 21 a b","P -2b 2a","29","","","","- C10 H12 O3 Se -","- C10 H12 O3 Se -","- C80 H96 O24 Se8 -","8","2","","Bhuyan, Bhaskar J.; Mugesh, Govindasamy","Synthesis, characterization and antioxidant activity of angiotensin converting enzyme inhibitors.","Organic & biomolecular chemistry","2011","9","5","1356","1365","10.1039/C0OB00823K","","","0.71073","MoKα","","0.0789","0.0529","","","0.0921","0.0993","","","","","","1.149","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151708","5.654","0.0009","7.4586","0.0012","13.1","0.002","90","","99.649","0.003","90","","544.62","0.15","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C12 H13 N O4 -","- C12 H13 N O4 -","- C24 H26 N2 O8 -","2","1","","Hong, Bor-Cherng; Kotame, Prakash; Liao, Ju-Hsiou","Enantioselective organocatalytic domino Michael-acetalization-Henry reactions of 2-hydroxynitrostyrene and aldehyde for the synthesis of tetrahydro-6H-benzo[c]chromenones.","Organic & biomolecular chemistry","2011","9","2","382","386","10.1039/C0OB00834F","","","0.71073","MoKα","","0.0439","0.0369","","","0.0849","0.0881","","","","","","1.071","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151709","6.8992","0.0008","6.9979","0.0008","24.978","0.003","90","","90","","90","","1205.9","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C12 H12 Br N O4 -","- C12 H12 Br N O4 -","- C48 H48 Br4 N4 O16 -","4","1","","Hong, Bor-Cherng; Kotame, Prakash; Liao, Ju-Hsiou","Enantioselective organocatalytic domino Michael-acetalization-Henry reactions of 2-hydroxynitrostyrene and aldehyde for the synthesis of tetrahydro-6H-benzo[c]chromenones.","Organic & biomolecular chemistry","2011","9","2","382","386","10.1039/C0OB00834F","","","0.71073","MoKα","","0.0304","0.025","","","0.0492","0.05","","","","","","0.984","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151710","5.331","0.002","7.848","0.003","14.735","0.006","90","","95.877","0.006","90","","613.2","0.4","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C13 H15 N O6 -","- C13 H15 N O6 -","- C26 H30 N2 O12 -","2","1","","Hong, Bor-Cherng; Kotame, Prakash; Liao, Ju-Hsiou","Enantioselective organocatalytic domino Michael-acetalization-Henry reactions of 2-hydroxynitrostyrene and aldehyde for the synthesis of tetrahydro-6H-benzo[c]chromenones.","Organic & biomolecular chemistry","2011","9","2","382","386","10.1039/C0OB00834F","","","0.71073","MoKα","","0.0327","0.032","","","0.0854","0.0879","","","","","","1.074","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7151711","9.7651","0.0006","11.2401","0.0008","11.3429","0.0009","76.03","0.001","81.135","0.001","73.662","0.001","1154.42","0.14","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H26 Cl N3 O2 -","- C27 H26 Cl N3 O2 -","- C54 H52 Cl2 N6 O4 -","2","1","","He, Ping; Nie, Yi-Bo; Wu, Jing; Ding, Ming-Wu","Unexpected synthesis of indolo[1,2-c]quinazolines by a sequential Ugi 4CC-Staudinger-aza-Wittig-nucleophilic addition reaction.","Organic & biomolecular chemistry","2011","9","5","1429","1436","10.1039/C0OB00855A","","","0.71073","MoKα","","0.0533","0.046","","","0.1267","0.1319","","","","","","1.041","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7151712","9.4053","0.0003","9.7021","0.0004","21.9587","0.001","90","","92.978","0.002","90","","2001.05","0.14","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H25 N O2 -","- C25 H25 N O2 -","- C100 H100 N4 O8 -","4","1","","Cheetham, Caroline A.; Massey, Richard S.; Pira, Silvain L.; Pritchard, Robin G.; Wallace, Timothy W.","Atroposelective formation of dibenz[c,e]azepines via intramolecular direct arylation with centre-axis chirality transfer.","Organic & biomolecular chemistry","2011","9","6","1831","1838","10.1039/C0OB00889C","","x-ray","0.71073","MoKα","","0.1888","0.0861","","","0.166","0.2154","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151713","13.333","0.002","10.094","0.002","11.308","0.004","90","","109.94","0.02","90","","1430.6","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H18 N2 O2 -","- C16 H18 N2 O2 -","- C64 H72 N8 O8 -","4","1","","Pozharskii, Alexander F.; Povalyakhina, Maria A.; Degtyarev, Alexander V.; Ryabtsova, Oxana V.; Ozeryanskii, Valery A.; Dyablo, Olga V.; Tkachuk, Anna V.; Kazheva, Olga N.; Chekhlov, Anatolii N.; Dyachenko, Oleg A.","Naphthalene proton sponges as hydride donors: diverse appearances of the tert-amino-effect.","Organic & biomolecular chemistry","2011","9","6","1887","1900","10.1039/C0OB00899K","","","0.7107","MoKα","","0.0692","0.0468","","","0.1245","0.1347","","","","","","1.214","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151714","6.6455","0.0007","12.928","0.0013","12.943","0.0013","101.997","0.002","90.461","0.002","94.532","0.002","1083.94","0.19","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C24 H22 N7 -","- C24 H22 N7 -","- C48 H44 N14 -","2","1","","Pozharskii, Alexander F.; Povalyakhina, Maria A.; Degtyarev, Alexander V.; Ryabtsova, Oxana V.; Ozeryanskii, Valery A.; Dyablo, Olga V.; Tkachuk, Anna V.; Kazheva, Olga N.; Chekhlov, Anatolii N.; Dyachenko, Oleg A.","Naphthalene proton sponges as hydride donors: diverse appearances of the tert-amino-effect.","Organic & biomolecular chemistry","2011","9","6","1887","1900","10.1039/C0OB00899K","","","0.71073","MoKα","","0.0669","0.0501","","","0.1227","0.1327","","","","","","1.03","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151715","34.582","0.002","10.1577","0.0006","8.339","0.0005","90","","92.891","0.001","90","","2925.5","0.3","295","2","295","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C20 H32 N4 -","- C20 H32 N4 -","- C120 H192 N24 -","6","3","","Pozharskii, Alexander F.; Povalyakhina, Maria A.; Degtyarev, Alexander V.; Ryabtsova, Oxana V.; Ozeryanskii, Valery A.; Dyablo, Olga V.; Tkachuk, Anna V.; Kazheva, Olga N.; Chekhlov, Anatolii N.; Dyachenko, Oleg A.","Naphthalene proton sponges as hydride donors: diverse appearances of the tert-amino-effect.","Organic & biomolecular chemistry","2011","9","6","1887","1900","10.1039/C0OB00899K","","","0.71073","MoKα","","0.1034","0.0464","","","0.087","0.1043","","","","","","1.012","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151716","10.247","0.004","11.52","0.004","34.634","0.013","90","","102.208","0.007","90","","3996","3","100","2","100","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C24 H22 N5 -","- C24 H22 N5 -","- C192 H176 N40 -","8","2","","Pozharskii, Alexander F.; Povalyakhina, Maria A.; Degtyarev, Alexander V.; Ryabtsova, Oxana V.; Ozeryanskii, Valery A.; Dyablo, Olga V.; Tkachuk, Anna V.; Kazheva, Olga N.; Chekhlov, Anatolii N.; Dyachenko, Oleg A.","Naphthalene proton sponges as hydride donors: diverse appearances of the tert-amino-effect.","Organic & biomolecular chemistry","2011","9","6","1887","1900","10.1039/C0OB00899K","","","0.71073","MoKα","","0.1712","0.0859","","","0.1414","0.1612","","","","","","1.038","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151717","12.173","0.002","14.445","0.002","8.223","0.002","90","","103.46","0.02","90","","1406.2","0.5","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H9 I O3 -","- C17 H9 I O3 -","- C68 H36 I4 O12 -","4","1","","Raffa, Guillaume; Belot, Sébastien; Balme, Geneviève; Monteiro, Nuno","Iodocyclization versus diiodination in the reaction of 3-alkynyl-4-methoxycoumarins with iodine: Synthesis of 3-iodofuro[2,3-b]chromones.","Organic & biomolecular chemistry","2011","9","5","1474","1478","10.1039/C0OB00935K","","","0.7107","MoKα","","0.1292","0.0934","","0.3093","0.2532","0.3093","","","","","","0.9991","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151718","18.6185","0.0003","14.0017","0.0003","14.1965","0.0003","90","","107.82","0.002","90","","3523.34","0.13","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H12 I2 O3 -","- C18 H12 I2 O3 -","- C144 H96 I16 O24 -","8","2","","Raffa, Guillaume; Belot, Sébastien; Balme, Geneviève; Monteiro, Nuno","Iodocyclization versus diiodination in the reaction of 3-alkynyl-4-methoxycoumarins with iodine: Synthesis of 3-iodofuro[2,3-b]chromones.","Organic & biomolecular chemistry","2011","9","5","1474","1478","10.1039/C0OB00935K","","","0.7107","MoKα","","0.0487","0.0343","","0.0755","0.0674","0.0755","","","","","","1.0021","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151719","10.27","0.003","11.202","0.003","18.897","0.006","90","","90","","90","","2174","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H21 Cl N2 O3 -","- C25 H21 Cl N2 O3 -","- C100 H84 Cl4 N8 O12 -","4","1","","Liu, Tang-Lin; Xue, Zhi-Yong; Tao, Hai-Yan; Wang, Chun-Jiang","Catalytic asymmetric 1,3-dipolar cycloaddition of N-unprotected 2-oxoindolin-3-ylidene derivatives and azomethine ylides for the construction of spirooxindole-pyrrolidines.","Organic & biomolecular chemistry","2011","9","6","1980","1986","10.1039/C0OB00943A","","","0.71073","MoKα","","0.036","0.0309","","","0.0785","0.0822","","","","","","1.034","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151720","16.012","0.01","11.932","0.007","19.682","0.012","90","","104.571","0.008","90","","3639","4","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C16 H9 F10 N5 O -","- C16 H9 F10 N5 O -","- C128 H72 F80 N40 O8 -","8","2","","Bose, Purnandhu; Ahamed, B. Nisar; Ghosh, Pradyut","Functionalized guanidinium chloride based colourimetric sensors for fluoride and acetate: single crystal X-ray structural evidence of -NH deprotonation and complexation.","Organic & biomolecular chemistry","2011","9","6","1972","1979","10.1039/C0OB00947D","","","0.71073","MoKα","","0.0815","0.0499","","","0.1123","0.1277","","","","","","1.022","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151721","14.5032","0.001","9.6882","0.0007","44.522","0.003","90","","90","","90","","6255.8","0.8","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C37 H31 N5 O4 -","- C37 H31 N5 O4 -","- C296 H248 N40 O32 -","8","1","","Bose, Purnandhu; Ahamed, B. Nisar; Ghosh, Pradyut","Functionalized guanidinium chloride based colourimetric sensors for fluoride and acetate: single crystal X-ray structural evidence of -NH deprotonation and complexation.","Organic & biomolecular chemistry","2011","9","6","1972","1979","10.1039/C0OB00947D","","","0.71073","MoKα","","0.1005","0.0879","","","0.2308","0.2407","","","","","","1.161","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151722","6.8654","0.0013","34.567","0.006","7.138","0.0014","90","","98.565","0.004","90","","1675.1","0.5","100","2","100","2","","","","","","","","5","P 1 21/m 1","-P 2yb","11","","","","- C36 H22 F10 N5 O6 -","- C36 H22 F10 N5 O6 -","- C72 H44 F20 N10 O12 -","2","0.5","","Bose, Purnandhu; Ahamed, B. Nisar; Ghosh, Pradyut","Functionalized guanidinium chloride based colourimetric sensors for fluoride and acetate: single crystal X-ray structural evidence of -NH deprotonation and complexation.","Organic & biomolecular chemistry","2011","9","6","1972","1979","10.1039/C0OB00947D","","","0.71073","MoKα","","0.04","0.0334","","","0.0842","0.0889","","","","","","1.078","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7151723","4.7615","0.0005","11.9406","0.0012","21.373","0.002","90","","93.296","0.002","90","","1213.2","0.2","100","","100","","","","","","","","diethylether,pentane","3","P 1 21/c 1","-P 2ybc","14","","","","- C18 H14 O -","- C18 H14 O -","- C72 H56 O4 -","4","1","","Böß, Esther; Hillringhaus, Tim; Nitsch, Jacqueline; Klussmann, Martin","Lewis acid-catalysed one pot synthesis of substituted xanthenes.","Organic & biomolecular chemistry","2011","9","6","1744","1748","10.1039/C0OB00954G","","","0.71073","Mo-Kα","","0.0566","0.0448","","","0.1263","0.1358","","","","","","1.037","","","","has coordinates","276358","2022-06-28","17:19:16",""
"7151724","7.3745","0.0019","8.763","0.003","10.395","0.002","99.79","0.02","110.27","0.02","98.47","0.03","605.3","0.3","100","","100","","","","","","","","Et2O, pentane","3","P -1","-P 1","2","","","","- C16 H16 O2 -","- C16 H16 O2 -","- C32 H32 O4 -","2","1","","Böß, Esther; Hillringhaus, Tim; Nitsch, Jacqueline; Klussmann, Martin","Lewis acid-catalysed one pot synthesis of substituted xanthenes.","Organic & biomolecular chemistry","2011","9","6","1744","1748","10.1039/C0OB00954G","","","0.71073","MoKα","","0.0618","0.0456","","","0.122","0.1339","","","","","","1.043","","","","has coordinates","276358","2022-06-28","17:19:16",""
"7151725","8.3831","0.001","11.7677","0.0015","15.012","0.0019","90","","90","","90","","1480.9","0.3","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H16 Si -","- C20 H16 Si -","- C80 H64 Si4 -","4","1","","Tanikawa, Tomoharu; Saito, Masaichi; Guo, Jing Dong; Nagase, Shigeru","Synthesis, structures and optical properties of trisilasumanene and its related compounds.","Organic & biomolecular chemistry","2011","9","6","1731","1735","10.1039/C0OB00987C","","","0.71073","MoKα","","0.0406","0.0381","","","0.0978","0.1005","","","","","","1.057","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151726","6.0046","0.0014","6.104","0.0014","12.099","0.003","90","","103.144","0.004","90","","431.84","0.18","150","2","150","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C8 H13 N O3 -","- C8 H13 N O3 -","- C16 H26 N2 O6 -","2","1","","Franklin, Andrew I.; Bensa, David; Adams, Harry; Coldham, Iain","Transannular dipolar cycloaddition as an approach towards the synthesis of the core ring system of the sarain alkaloids.","Organic & biomolecular chemistry","2011","9","6","1901","1907","10.1039/C0OB01019G","","","0.71073","MoKα","","0.036","0.0319","","","0.0832","0.0855","","","","","","1.106","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151727","9.5861","0.001","14.757","0.0015","19.402","0.002","90","","90","","90","","2744.6","0.5","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C30 H30 Br2 N2 O4 -","- C30 H30 Br2 N2 O4 -","- C120 H120 Br8 N8 O16 -","4","1","","Franklin, Andrew I.; Bensa, David; Adams, Harry; Coldham, Iain","Transannular dipolar cycloaddition as an approach towards the synthesis of the core ring system of the sarain alkaloids.","Organic & biomolecular chemistry","2011","9","6","1901","1907","10.1039/C0OB01019G","","","0.71073","MoKα","","0.1119","0.0652","","","0.1519","0.1826","","","","","","1.142","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151728","9.772","0.002","17.25","0.004","11.937","0.002","90","","97.6","0.03","90","","1994.5","0.7","113","2","113","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C37 H52 Cl N O11 -","- C37 H52 Cl N O11 -","- C74 H104 Cl2 N2 O22 -","2","1","","Yu, Jipan; Miao, Zhiwei; Chen, Ruyu","Highly efficient asymmetric vinylogous Mannich reaction induced by O-pivaloylated d-galactosylamine as the chiral auxiliary.","Organic & biomolecular chemistry","2011","9","6","1756","1762","10.1039/C0OB01048K","","","0.71073","MoKα","","0.0655","0.0534","","","0.1276","0.1373","","","","","","1.017","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151729","7.5239","0.0004","13.8384","0.0008","22.5279","0.0014","90","","90","","90","","2345.6","0.2","200","2","200","2","","","","","","","","3","P b c a","-P 2ac 2ab","61","","","","- C32 H18 N4 -","- C32 H18 N4 -","- C128 H72 N16 -","4","0.5","","Lin, Yi-Chun; Lin, Chih-Hsiu; Chen, Chan-Yu; Sun, Shih-Sheng; Pal, Bikash","Synthesis of electron deficient acene derivatives via a bidirectional iterative elongation reaction","Organic & Biomolecular Chemistry","2011","9","12","4507","","10.1039/c0ob00575d","","","0.71073","MoKα","","0.1515","0.049","","","0.1062","0.1486","","","","","","0.91","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151730","8.0678","0.0001","16.6957","0.0002","9.6537","0.0001","90","","99.437","0.001","90","","1282.73","0.03","100","2","100","2","","","","","","","","6","P 1 21 1","P 2yb","4","1,2-syn-2,3-anti-iodoalcohol","(1S,2S,3S)-1-(2',2',2'-trichloromethylcarbonylamino)-2-hydroxy-3-iodocyclohexane","","- C8 H11 Cl3 I N O2 -","- C8 H11 Cl3 I N O2 -","- C32 H44 Cl12 I4 N4 O8 -","4","2","","Ahmad, Sajjad; Thomas, Lynne H.; Sutherland, Andrew","Stereoselective synthesis of polyhydroxylated aminocyclohexanes.","Organic & biomolecular chemistry","2011","9","8","2801","2808","10.1039/c0ob00619j","","","0.71073","MoKα","","0.0449","0.0313","","","","0.0585","","","","","","0.977","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151731","39.705","0.002","5.8312","0.0003","20.2162","0.0014","90","","91.296","0.002","90","","4679.4","0.5","100","2","100","2","","","","","","","","5","C 1 2 1","C 2y","5","","(1S,2S,3S,4S)-1-(2?,2?,2?-trichloromethylcarbonylamino)-2,3,4- trihydroxycyclohexane ?","","- C8 H12 Cl3 N O4 -","- C8 H12 Cl3 N O4 -","- C128 H192 Cl48 N16 O64 -","16","4","","Ahmad, Sajjad; Thomas, Lynne H.; Sutherland, Andrew","Stereoselective synthesis of polyhydroxylated aminocyclohexanes.","Organic & biomolecular chemistry","2011","9","8","2801","2808","10.1039/c0ob00619j","","","0.71073","MoKα","","0.1714","0.0752","","","","0.1434","","","","","","1.059","","","","has coordinates,has disorder","193998","2020-10-21","18:00:00",""
"7151732","9.4283","0.0016","10.252","0.002","14.872","0.004","77.695","0.017","79.25","0.017","71.711","0.014","1322.4","0.5","293","2","293","2","","","","","","","","4","P -1","-P 1","2","Compound-24A","","","- C34 H30 N2 O -","- C34 H30 N2 O -","- C68 H60 N4 O2 -","2","1","","He, Yong; Krishnamoorthy, Pasupathy; Lima, Heather M.; Chen, Yingzhong; Wu, Haiyan; Sivappa, Rasapalli; Dias, H. V. Rasika; Lovely, Carl J.","Intramolecular Diels-Alder chemistry of 4-vinylimidazoles.","Organic & biomolecular chemistry","2011","9","8","2685","2701","10.1039/c0ob00657b","","","0.71073","MoKα","","0.0826","0.0517","","","0.1156","0.1313","","","","","","1.01","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151733","10.5806","0.0005","10.1271","0.0005","40.3707","0.0018","90","","90","","90","","4325.8","0.4","100","2","100","2","","","","","","","","5","P c a 21","P 2c -2ac","29","Compound-66","","","- C24 H26 N4 O3 S -","- C24 H26 N4 O3 S -","- C192 H208 N32 O24 S8 -","8","2","","He, Yong; Krishnamoorthy, Pasupathy; Lima, Heather M.; Chen, Yingzhong; Wu, Haiyan; Sivappa, Rasapalli; Dias, H. V. Rasika; Lovely, Carl J.","Intramolecular Diels-Alder chemistry of 4-vinylimidazoles.","Organic & biomolecular chemistry","2011","9","8","2685","2701","10.1039/c0ob00657b","","","0.71073","MoKα","","0.05","0.0425","","","0.0916","0.095","","","","","","1.085","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151734","16.9209","0.0013","10.9678","0.0009","19.3539","0.0015","90","","114.309","0.001","90","","3273.3","0.4","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","Compound-72","","","- C30 H35 Cl2 N7 O5 S2 -","- C30 H35 Cl2 N7 O5 S2 -","- C120 H140 Cl8 N28 O20 S8 -","4","1","","He, Yong; Krishnamoorthy, Pasupathy; Lima, Heather M.; Chen, Yingzhong; Wu, Haiyan; Sivappa, Rasapalli; Dias, H. V. Rasika; Lovely, Carl J.","Intramolecular Diels-Alder chemistry of 4-vinylimidazoles.","Organic & biomolecular chemistry","2011","9","8","2685","2701","10.1039/c0ob00657b","","","0.71073","MoKα","","0.056","0.0445","","","0.1164","0.1247","","","","","","1.027","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151735","8.3372","0.0004","10.931","0.0007","9.7141","0.0003","90","","94.165","0.003","90","","882.95","0.08","208","2","208","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C11 H10 O3 -","- C11 H10 O3 -","- C44 H40 O12 -","4","1","","Malik, Heetika; Kohlen, Wouter; Jamil, Muhammad; Rutjes, Floris P. J. T.; Zwanenburg, Binne","Aromatic A-ring analogues of orobanchol, new germination stimulants for seeds of parasitic weeds.","Organic & biomolecular chemistry","2011","9","7","2286","2293","10.1039/c0ob00735h","","","0.71073","MoKα","","0.0537","0.0429","","0.1012","0.0959","0.1012","","","1.098","","","1.098","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151736","6.8264","0.0003","8.0831","0.0003","12.8838","0.0011","91.219","0.004","96.917","0.006","94.85","0.004","702.85","0.07","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C17 H14 O6 -","- C17 H14 O6 -","- C34 H28 O12 -","2","1","","Malik, Heetika; Kohlen, Wouter; Jamil, Muhammad; Rutjes, Floris P. J. T.; Zwanenburg, Binne","Aromatic A-ring analogues of orobanchol, new germination stimulants for seeds of parasitic weeds.","Organic & biomolecular chemistry","2011","9","7","2286","2293","10.1039/c0ob00735h","","","0.71073","MoKα","","0.1218","0.1001","","0.3089","0.2932","0.3089","","","1.076","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151737","8.1223","0.0003","7.04","0.0005","13.0388","0.0003","90","","107.502","0.004","90","","711.06","0.06","293","2","293","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C17 H14 O6 -","- C17 H14 O6 -","- C34 H28 O12 -","2","1","","Malik, Heetika; Kohlen, Wouter; Jamil, Muhammad; Rutjes, Floris P. J. T.; Zwanenburg, Binne","Aromatic A-ring analogues of orobanchol, new germination stimulants for seeds of parasitic weeds.","Organic & biomolecular chemistry","2011","9","7","2286","2293","10.1039/c0ob00735h","","","0.71073","MoKα","","0.0397","0.0341","","0.0797","0.077","0.0797","","","1.083","","","1.083","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151738","6.6845","0.0009","7.9964","0.001","26.937","0.003","90","","94.935","0.008","90","","1434.5","0.3","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H14 O6 -","- C17 H14 O6 -","- C68 H56 O24 -","4","1","","Malik, Heetika; Kohlen, Wouter; Jamil, Muhammad; Rutjes, Floris P. J. T.; Zwanenburg, Binne","Aromatic A-ring analogues of orobanchol, new germination stimulants for seeds of parasitic weeds.","Organic & biomolecular chemistry","2011","9","7","2286","2293","10.1039/c0ob00735h","","","0.71073","MoKα","","0.135","0.0793","","0.1847","0.1549","0.1847","","","1.185","","","1.185","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151739","8.558","0.0012","15.813","0.002","16.673","0.002","90","","98.473","0.005","90","","2231.7","0.5","113","2","113","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H23 Br N2 O6 -","- C24 H23 Br N2 O6 -","- C96 H92 Br4 N8 O24 -","4","1","","Pan, Huan-Rui; Wang, Xiao-Rong; Yan, Cai-Xia; Sun, Zhong-Xin; Cheng, Ying","The multicomponent reaction of imidazo[1,5-a]pyridine carbenes with phthalaldehydes and dimethyl acetylenedicarboxylate: a facile construction of benzo[d]furo[3,2-b]azepines.","Organic & biomolecular chemistry","2011","9","7","2166","2174","10.1039/c0ob00746c","","","0.71073","MoKα","","0.043","0.0317","","","0.0676","0.0707","","","","","","0.978","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151740","29.508","0.001","29.508","0.001","12.139","0.001","90","","90","","90","","10569.7","1","293","2","293","2","","","","","","","","5","P -4","P -4","81","","?(5S,6R)-Dimethyl 8-bromo-6-hydroxyl-4-isopropyl-5-(2-pyridyl)- 5,6-dihydrobenzo[d]furo[3,2-b]azepine-2,3-dicarboxylate","","- C24 H23 Br N2 O6 -","- C24 H23 Br N2 O6 -","- C384 H368 Br16 N32 O96 -","16","4","","Pan, Huan-Rui; Wang, Xiao-Rong; Yan, Cai-Xia; Sun, Zhong-Xin; Cheng, Ying","The multicomponent reaction of imidazo[1,5-a]pyridine carbenes with phthalaldehydes and dimethyl acetylenedicarboxylate: a facile construction of benzo[d]furo[3,2-b]azepines.","Organic & biomolecular chemistry","2011","9","7","2166","2174","10.1039/c0ob00746c","","","0.71073","MoKα","","0.0735","0.0446","","","0.0964","0.1038","","","","","","0.971","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151741","7.9953","0.0017","12.083","0.003","13.275","0.003","65.855","0.003","88.718","0.004","84.251","0.004","1164.1","0.5","296","2","296","2","","","","","","","","5","P -1","-P 1","2","5S,6S)-Dimethyl 8-bromo-6-hydroxyl-4-isopropyl-5-(2-pyridyl)- 5,6-dihydrobenzo(d)furo(3,2-b)azepine-2,3-dicarboxylate","5S,6S)-Dimethyl 8-bromo-6-hydroxyl-4-isopropyl-5- (2-pyridyl)-5,6-dihydrobenzo[d]furo[3,2-b]azepine-2,3-dicarboxylate","","- C24 H23 Br N2 O6 -","- C24 H23 Br N2 O6 -","- C48 H46 Br2 N4 O12 -","2","1","","Pan, Huan-Rui; Wang, Xiao-Rong; Yan, Cai-Xia; Sun, Zhong-Xin; Cheng, Ying","The multicomponent reaction of imidazo[1,5-a]pyridine carbenes with phthalaldehydes and dimethyl acetylenedicarboxylate: a facile construction of benzo[d]furo[3,2-b]azepines.","Organic & biomolecular chemistry","2011","9","7","2166","2174","10.1039/c0ob00746c","","","0.71073","MoKα","","0.0504","0.0352","","","0.0788","0.085","","","","","","1.018","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151742","5.4822","0.0004","8.8469","0.0006","24.9538","0.0017","90","","90","","90","","1210.27","0.15","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 O4 -","- C14 H16 O4 -","- C56 H64 O16 -","4","1","","Nesbitt, Caroline L.; McErlean, Christopher S. P.","Total synthesis of C19 lipid diols containing a 2,5-disubstituted-3-oxygenated tetrahydrofuran.","Organic & biomolecular chemistry","2011","9","7","2198","2208","10.1039/c0ob00754d","","","0.71073","MoKα","","0.0334","0.0321","","","0.0895","0.0908","","","","","","1.041","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151743","5.4962","0.001","14.702","0.003","14.657","0.003","90","","100.037","0.003","90","","1166.2","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C27 H22 Br N O4 -","- C27 H22 Br N O4 -","- C54 H44 Br2 N2 O8 -","2","1","","Li, Wenjun; Wu, Wenbin; Yu, Feng; Huang, Huicai; Liang, Xinmiao; Ye, Jinxing","Catalytic asymmetric Michael addition with curcumin derivative.","Organic & biomolecular chemistry","2011","9","7","2505","2511","10.1039/c0ob00757a","","","0.71073","MoKα","","0.0803","0.059","","","0.1375","0.1467","","","","","","0.938","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151744","7.0225","0.0008","7.3868","0.0008","13.8536","0.0015","90","","100.912","0.002","90","","705.65","0.13","130","2","130","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C4 H9 Cl O2 S -","- C4 H9 Cl O2 S -","- C16 H36 Cl4 O8 S4 -","4","1","","Yoo, Ellie Jung-Hwa; Feketeová, Linda; Khairallah, George N.; White, Jonathan M.; O'Hair, Richard A J","Structure and unimolecular chemistry of protonated sulfur betaines, (CH3)2S(+)(CH2)(n)CO2H (n = 1 and 2).","Organic & biomolecular chemistry","2011","9","8","2751","2759","10.1039/c0ob00770f","","","0.71073","MoKα","","0.0288","0.0269","","","0.0753","0.0768","","","","","","1.097","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151745","7.3627","0.0009","9.589","0.0009","11.7822","0.0019","69.895","0.012","73.702","0.012","79.988","0.009","746.99","0.18","130","2","130","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H13 N3 O9 S -","- C11 H13 N3 O9 S -","- C22 H26 N6 O18 S2 -","2","1","","Yoo, Ellie Jung-Hwa; Feketeová, Linda; Khairallah, George N.; White, Jonathan M.; O'Hair, Richard A J","Structure and unimolecular chemistry of protonated sulfur betaines, (CH3)2S(+)(CH2)(n)CO2H (n = 1 and 2).","Organic & biomolecular chemistry","2011","9","8","2751","2759","10.1039/c0ob00770f","","","1.54184","CuKα","","0.1143","0.0543","","","0.1045","0.12","","","","","","0.777","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151746","16.927","0.003","12.667","0.003","18.063","0.004","90","","90","","90","","3873","1.4","293","2","293","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C24 H17 N2 O3 -","- C24 H17 N2 O3 -","- C192 H136 N16 O24 -","8","2","","Qi, Hengzhen; Li, Xinyao; Xu, Jiaxi","Stereoselective control in the Staudinger reactions involving monosubstituted ketenes with electron acceptor substituents: experimental investigation and theoretical rationalization.","Organic & biomolecular chemistry","2011","9","8","2702","2714","10.1039/c0ob00783h","","","0.71073","MoKα","","0.1151","0.057","","","0.1081","0.1233","","","","","","0.977","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151747","12.294","0.004","4.9467","0.0014","20.381","0.006","90","","101.322","0.004","90","","1215.3","0.6","93","2","93","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H12 N2 O -","- C16 H12 N2 O -","- C64 H48 N8 O4 -","4","1","","Qi, Hengzhen; Li, Xinyao; Xu, Jiaxi","Stereoselective control in the Staudinger reactions involving monosubstituted ketenes with electron acceptor substituents: experimental investigation and theoretical rationalization.","Organic & biomolecular chemistry","2011","9","8","2702","2714","10.1039/c0ob00783h","","","0.71073","MoKα","","0.0715","0.0453","","","0.0937","0.1044","","","","","","0.999","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151748","13.0912","0.0007","13.0912","0.0007","23.1759","0.0012","90","","90","","90","","3971.9","0.4","150","2","150","2","","","","","","","","5","I 41 c d","I 4bw -2c","110","","","","- C11 H5 F4 N O -","- C11 H5 F4 N O -","- C176 H80 F64 N16 O16 -","16","1","","Ponce González, Julia; Edgar, Mark; Elsegood, Mark R. J.; Weaver, George W.","Synthesis of fluorinated fused benzofurans and benzothiophenes: Smiles-type rearrangement and cyclisation of perfluoro(het)aryl ethers and sulfides.","Organic & biomolecular chemistry","2011","9","7","2294","2305","10.1039/c0ob00790k","","","0.71073","MoKα","","0.0336","0.0305","","","0.0824","0.0849","","","","","","1.058","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151749","7.0016","0.0012","10.9436","0.0019","17.466","0.003","92.675","0.003","99.643","0.003","90.003","0.003","1317.9","0.4","150","2","150","2","","","","","","","","6","P -1","-P 1","2","","","","- C26.5 H16 Br3 F2 N S3 -","- C26.5 H16 Br3 F2 N S3 -","- C53 H32 Br6 F4 N2 S6 -","2","1","","Ponce González, Julia; Edgar, Mark; Elsegood, Mark R. J.; Weaver, George W.","Synthesis of fluorinated fused benzofurans and benzothiophenes: Smiles-type rearrangement and cyclisation of perfluoro(het)aryl ethers and sulfides.","Organic & biomolecular chemistry","2011","9","7","2294","2305","10.1039/c0ob00790k","","","0.71073","MoKα","","0.0837","0.0547","","","0.1496","0.1632","","","","","","1.038","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7151750","7.223","0.0008","7.9584","0.0009","9.1866","0.001","100.979","0.002","97.143","0.002","113.863","0.002","462.01","0.09","150","2","150","2","","","","","","","","5","P -1","-P 1","2","","","","- C11 H4 F3 N S -","- C11 H4 F3 N S -","- C22 H8 F6 N2 S2 -","2","1","","Ponce González, Julia; Edgar, Mark; Elsegood, Mark R. J.; Weaver, George W.","Synthesis of fluorinated fused benzofurans and benzothiophenes: Smiles-type rearrangement and cyclisation of perfluoro(het)aryl ethers and sulfides.","Organic & biomolecular chemistry","2011","9","7","2294","2305","10.1039/c0ob00790k","","","0.71073","MoKα","","0.0401","0.0343","","","0.0848","0.0881","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151751","6.198","0.002","6.525","0.002","15.416","0.005","90","","97.211","0.004","90","","618.5","0.3","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H8 F2 O2 -","- C18 H8 F2 O2 -","- C36 H16 F4 O4 -","2","0.5","","Ponce González, Julia; Edgar, Mark; Elsegood, Mark R. J.; Weaver, George W.","Synthesis of fluorinated fused benzofurans and benzothiophenes: Smiles-type rearrangement and cyclisation of perfluoro(het)aryl ethers and sulfides.","Organic & biomolecular chemistry","2011","9","7","2294","2305","10.1039/c0ob00790k","","","0.6942","synchrotron","","0.1365","0.0949","","","0.248","0.2902","","","","","","1.041","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151752","9.8845","0.0005","15.668","0.0008","10.3729","0.0005","90","","92.2845","0.0008","90","","1605.18","0.14","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H8 Br F3 S2 -","- C18 H8 Br F3 S2 -","- C72 H32 Br4 F12 S8 -","4","1","","Ponce González, Julia; Edgar, Mark; Elsegood, Mark R. J.; Weaver, George W.","Synthesis of fluorinated fused benzofurans and benzothiophenes: Smiles-type rearrangement and cyclisation of perfluoro(het)aryl ethers and sulfides.","Organic & biomolecular chemistry","2011","9","7","2294","2305","10.1039/c0ob00790k","","","0.71073","MoKα","","0.054","0.0378","","","0.0899","0.0976","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151753","15.1514","0.0009","12.9717","0.0008","8.1916","0.0005","90","","103.522","0.0009","90","","1565.34","0.16","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H8 Br F3 S2 -","- C18 H8 Br F3 S2 -","- C72 H32 Br4 F12 S8 -","4","1","","Ponce González, Julia; Edgar, Mark; Elsegood, Mark R. J.; Weaver, George W.","Synthesis of fluorinated fused benzofurans and benzothiophenes: Smiles-type rearrangement and cyclisation of perfluoro(het)aryl ethers and sulfides.","Organic & biomolecular chemistry","2011","9","7","2294","2305","10.1039/c0ob00790k","","","0.71073","MoKα","","0.0522","0.0355","","","0.0922","0.1012","","","","","","1.023","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151754","7.823","0.002","3.911","0.0012","21.623","0.007","90","","92.499","0.004","90","","660.9","0.3","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H8 F2 S2 -","- C18 H8 F2 S2 -","- C36 H16 F4 S4 -","2","0.5","","Ponce González, Julia; Edgar, Mark; Elsegood, Mark R. J.; Weaver, George W.","Synthesis of fluorinated fused benzofurans and benzothiophenes: Smiles-type rearrangement and cyclisation of perfluoro(het)aryl ethers and sulfides.","Organic & biomolecular chemistry","2011","9","7","2294","2305","10.1039/c0ob00790k","","","0.71073","MoKα","","0.0761","0.0559","","","0.1285","0.1366","","","","","","1.079","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151755","5.6949","0.0016","9.6545","0.0013","13.611","0.002","73.2","0.03","83.98","0.04","80.88","0.04","706","0.3","125","2","125","2","","","","","","","","5","P -1","-P 1","2","","","","- C14 H18 N2 O4 S -","- C14 H18 N2 O4 S -","- C28 H36 N4 O8 S2 -","2","1","","Kissane, Marie; Murphy, Maureen; O'Brien, Elisabeth; Chopra, Jay; Murphy, Linda; Collins, Stuart G.; Lawrence, Simon E.; Maguire, Anita R.","Addition-substitution reactions of 2-thio-3-chloroacrylamides with carbon, nitrogen, oxygen, sulfur and selenium nucleophiles.","Organic & biomolecular chemistry","2011","9","7","2452","2472","10.1039/c0ob00805b","","","0.71075","MoKα","","0.0786","0.0683","","","0.175","0.1817","","","","","","1.132","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151756","5.3188","0.0018","12.594","0.004","29.209","0.01","90","","90","","90","","1956.6","1.1","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H25 N O4 S -","- C20 H25 N O4 S -","- C80 H100 N4 O16 S4 -","4","1","","Kissane, Marie; Murphy, Maureen; O'Brien, Elisabeth; Chopra, Jay; Murphy, Linda; Collins, Stuart G.; Lawrence, Simon E.; Maguire, Anita R.","Addition-substitution reactions of 2-thio-3-chloroacrylamides with carbon, nitrogen, oxygen, sulfur and selenium nucleophiles.","Organic & biomolecular chemistry","2011","9","7","2452","2472","10.1039/c0ob00805b","","","0.71073","MoKα","","0.1722","0.0701","","","0.1259","0.1613","","","","","","0.992","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151757","8.37","0.003","11","0.004","12.192","0.003","90","","90","","90","","1122.5","0.6","298","2","298","2","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- C9 H14 N2 O2 Se -","- C9 H14 N2 O2 Se -","- C36 H56 N8 O8 Se4 -","4","1","","Hodage, Ananda S.; Phadnis, Prasad P.; Wadawale, Amey; Priyadarsini, K. I.; Jain, Vimal K.","Synthesis, characterization and structures of 2-(3,5-dimethylpyrazol-1-yl)ethylseleno derivatives and their probable glutathione peroxidase (GPx) like activity.","Organic & biomolecular chemistry","2011","9","8","2992","2998","10.1039/c0ob00807a","","","0.71069","MoKα","","0.1054","0.04","","","0.0965","0.1178","","","","","","0.984","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151758","13.2","0.005","11.169","0.005","7.993","0.004","90","","92.12","0.04","90","","1177.6","0.9","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C10 H16 N2 O2 Se -","- C10 H16 N2 O2 Se -","- C40 H64 N8 O8 Se4 -","4","1","","Hodage, Ananda S.; Phadnis, Prasad P.; Wadawale, Amey; Priyadarsini, K. I.; Jain, Vimal K.","Synthesis, characterization and structures of 2-(3,5-dimethylpyrazol-1-yl)ethylseleno derivatives and their probable glutathione peroxidase (GPx) like activity.","Organic & biomolecular chemistry","2011","9","8","2992","2998","10.1039/c0ob00807a","","","0.71073","MoKα","","0.1006","0.0372","","","0.0775","0.0977","","","","","","1","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151759","5.6366","0.0002","12.6433","0.0007","16.9777","0.0007","90","","90","","90","","1209.92","0.09","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C12 H11 N O5 -","- C12 H13 N O5 -","- C48 H52 N4 O20 -","4","1","","Ramachary, Dhevalapally B.; Prasad, M. Shiva; Madhavachary, R.","A general approach to high-yielding asymmetric synthesis of chiral 3-alkyl-4-nitromethylchromans via cascade Barbas-Michael and acetalization reactions.","Organic & biomolecular chemistry","2011","9","8","2715","2721","10.1039/c0ob00861c","","","1.54184","CuKα","","0.094","0.092","","","0.2279","0.2354","","","","","","1.118","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151760","8.8274","0.0005","13.2339","0.0006","12.3855","0.0007","90","","103.267","0.006","90","","1408.27","0.13","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C17 H17 N O2 -","- C17 H17 N O2 -","- C68 H68 N4 O8 -","4","1","","Blangetti, Marco; Deagostino, Annamaria; Gervasio, Giuliana; Marabello, Domenica; Prandi, Cristina; Venturello, Paolo","Superbase promoted synthesis of dienamides as useful intermediates for the synthesis of α-ketoamides, γ-lactams and cyclic imino ethers.","Organic & biomolecular chemistry","2011","9","7","2535","2538","10.1039/c0ob00867b","","","0.7107","MoKα","","0.105","0.0634","","","0.1687","0.1837","","","","","","1.054","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151761","14.0009","0.0006","8.4953","0.0003","26.87","0.0012","90","","97.115","0.004","90","","3171.4","0.2","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N O2 -","- C18 H19 N O2 -","- C144 H152 N8 O16 -","8","2","","Blangetti, Marco; Deagostino, Annamaria; Gervasio, Giuliana; Marabello, Domenica; Prandi, Cristina; Venturello, Paolo","Superbase promoted synthesis of dienamides as useful intermediates for the synthesis of α-ketoamides, γ-lactams and cyclic imino ethers.","Organic & biomolecular chemistry","2011","9","7","2535","2538","10.1039/c0ob00867b","","","0.7107","MoKα","","0.2104","0.0427","","","0.0773","0.0848","","","","","","0.949","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151762","14.5941","0.0004","9.4049","0.0002","13.8121","0.0003","90","","91.949","0.002","90","","1894.7","0.08","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C20 H26 O6 -","- C20 H26 O6 -","- C80 H104 O24 -","4","1","","Haning, Helmut; Giró-Mañas, Carles; Paddock, Victoria L.; Bochet, Christian G.; White, Andrew J. P.; Bernardinelli, Gerald; Mann, Inderjit; Oppolzer, Wolfang; Spivey, Alan C.","Total synthesis of the Amaryllidaceae alkaloid clivonine.","Organic & biomolecular chemistry","2011","9","8","2809","2820","10.1039/c0ob00895h","","","0.71073","MoKα","","0.0976","0.0448","","","0.102","0.1191","","","","","","0.936","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151763","7.2818","0.0001","33.8728","0.0003","8.3252","0.0001","90","","104.148","0.001","90","","1991.17","0.04","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H29 N O6 -","- C21 H29 N O6 -","- C84 H116 N4 O24 -","4","1","","Haning, Helmut; Giró-Mañas, Carles; Paddock, Victoria L.; Bochet, Christian G.; White, Andrew J. P.; Bernardinelli, Gerald; Mann, Inderjit; Oppolzer, Wolfang; Spivey, Alan C.","Total synthesis of the Amaryllidaceae alkaloid clivonine.","Organic & biomolecular chemistry","2011","9","8","2809","2820","10.1039/c0ob00895h","","","1.54184","CuKα","","0.0458","0.0424","","","0.1224","0.1248","","","","","","1.088","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151764","10.695","0.001","10.695","0.001","25.134","0.004","90","","90","","120","","2489.7","0.5","298","2","298","2","","","","","","","","4","P 61","P 61","169","","","","- C19 H23 N O4 -","- C19 H23 N O4 -","- C114 H138 N6 O24 -","6","1","","Haning, Helmut; Giró-Mañas, Carles; Paddock, Victoria L.; Bochet, Christian G.; White, Andrew J. P.; Bernardinelli, Gerald; Mann, Inderjit; Oppolzer, Wolfang; Spivey, Alan C.","Total synthesis of the Amaryllidaceae alkaloid clivonine.","Organic & biomolecular chemistry","2011","9","8","2809","2820","10.1039/c0ob00895h","","","0.71073","MoKα","","0.1136","0.0446","","","0.0727","0.0846","","","","","","0.959","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151765","6.0988","0.0002","11.8551","0.0004","16.3205","0.0005","102.804","0.003","98.74","0.003","102.13","0.003","1100.31","0.07","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H26 Cl N O5 -","- C25 H26 Cl N O5 -","- C50 H52 Cl2 N2 O10 -","2","1","","Haning, Helmut; Giró-Mañas, Carles; Paddock, Victoria L.; Bochet, Christian G.; White, Andrew J. P.; Bernardinelli, Gerald; Mann, Inderjit; Oppolzer, Wolfang; Spivey, Alan C.","Total synthesis of the Amaryllidaceae alkaloid clivonine.","Organic & biomolecular chemistry","2011","9","8","2809","2820","10.1039/c0ob00895h","","","1.54248","CuKα","","0.0511","0.0368","","","0.1013","0.1087","","","","","","1.042","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151766","10.834","0.01","12.591","0.012","13.097","0.012","90","","105.513","0.012","90","","1721","3","273","2","273","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H19 B F2 N2 O -","- C19 H19 B F2 N2 O -","- C76 H76 B4 F8 N8 O4 -","4","1","","Guo, Huimin; Jing, Yingying; Yuan, Xiaolin; Ji, Shaomin; Zhao, Jianzhang; Li, Xiaohuan; Kan, Yanyan","Highly selective fluorescent OFF-ON thiol probes based on dyads of BODIPY and potent intramolecular electron sink 2,4-dinitrobenzenesulfonyl subunits.","Organic & biomolecular chemistry","2011","9","10","3844","3853","10.1039/c0ob00910e","","","0.71073","MoKα","","0.1724","0.0683","","","0.158","0.2024","","","","","","0.916","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151767","16.6953","0.0006","17.6555","0.0007","17.3203","0.0006","90","","96.247","0.002","90","","5075.1","0.3","273","2","273","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C25 H21 B F2 N4 O7 S -","- C25 H21 B F2 N4 O7 S -","- C200 H168 B8 F16 N32 O56 S8 -","8","2","","Guo, Huimin; Jing, Yingying; Yuan, Xiaolin; Ji, Shaomin; Zhao, Jianzhang; Li, Xiaohuan; Kan, Yanyan","Highly selective fluorescent OFF-ON thiol probes based on dyads of BODIPY and potent intramolecular electron sink 2,4-dinitrobenzenesulfonyl subunits.","Organic & biomolecular chemistry","2011","9","10","3844","3853","10.1039/c0ob00910e","","","0.71073","MoKα","","0.0904","0.0567","","","0.1588","0.1737","","","","","","1.051","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151768","8.9837","0.0005","16.6227","0.001","17.0722","0.0009","95.666","0.004","95.646","0.004","94.209","0.004","2515.8","0.2","273","2","273","2","","","","","","","","7","P -1","-P 1","2","","","","- C25 H21 B F2 N4 O7 S -","- C25 H21 B F2 N4 O7 S -","- C100 H84 B4 F8 N16 O28 S4 -","4","2","","Guo, Huimin; Jing, Yingying; Yuan, Xiaolin; Ji, Shaomin; Zhao, Jianzhang; Li, Xiaohuan; Kan, Yanyan","Highly selective fluorescent OFF-ON thiol probes based on dyads of BODIPY and potent intramolecular electron sink 2,4-dinitrobenzenesulfonyl subunits.","Organic & biomolecular chemistry","2011","9","10","3844","3853","10.1039/c0ob00910e","","","0.71073","MoKα","","0.1097","0.0613","","","0.1637","0.1913","","","","","","1.007","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151769","13.9348","0.0003","12.1131","0.0002","23.212","0.0005","90","","92.073","0.001","90","","3915.47","0.14","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C42 H48 Cl O4 P -","- C42 H48 Cl O4 P -","- C168 H192 Cl4 O16 P4 -","4","1","","Chen, Ko-Wei; Syu, Siang-en; Jang, Yeong-Jiunn; Lin, Wenwei","A facile approach to highly functional trisubstituted furans via intramolecular Wittig reactions.","Organic & biomolecular chemistry","2011","9","7","2098","2106","10.1039/c0ob00912a","","","0.71073","MoKα","","0.1092","0.0711","","","0.2109","0.2455","","","","","","1.1","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151770","7.7171","0.0003","12.5408","0.0005","17.2932","0.0007","90","","98.71","0.002","90","","1654.31","0.11","200","2","200","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H15 Br O -","- C22 H15 Br O -","- C88 H60 Br4 O4 -","4","1","","Chen, Ko-Wei; Syu, Siang-en; Jang, Yeong-Jiunn; Lin, Wenwei","A facile approach to highly functional trisubstituted furans via intramolecular Wittig reactions.","Organic & biomolecular chemistry","2011","9","7","2098","2106","10.1039/c0ob00912a","","","0.71073","MoKα","","0.0462","0.0344","","","0.0743","0.0781","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151771","8.4569","0.0002","21.6536","0.0007","10.4183","0.0003","90","","111.158","0.002","90","","1779.21","0.09","200","2","200","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C23 H14 Br N O -","- C23 H14 Br N O -","- C92 H56 Br4 N4 O4 -","4","1","","Chen, Ko-Wei; Syu, Siang-en; Jang, Yeong-Jiunn; Lin, Wenwei","A facile approach to highly functional trisubstituted furans via intramolecular Wittig reactions.","Organic & biomolecular chemistry","2011","9","7","2098","2106","10.1039/c0ob00912a","","","0.71073","MoKα","","0.0402","0.0285","","","0.0627","0.0666","","","","","","1.029","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151772","5.6695","0.0005","13.7791","0.0013","18.04","0.0017","90","","95.532","0.011","90","","1402.7","0.2","297","","297","1","","","","","","","see text","3","P 1 21 1","P 2yb","4","","","","- C15 H20 O4 -","- C15 H20 O4 -","- C60 H80 O16 -","4","2","","Schanderl, Martin; Jeong, Won Boo; Schwarz, Michael; Reiser, Oliver","Stereoselective rearrangement of guaianolides to tricyclic δ-valerolactones.","Organic & biomolecular chemistry","2011","9","7","2543","2547","10.1039/c0ob00919a","","","0.71073","MoKα","","0.1075","0.0469","","","0.1047","0.1228","","","","","","0.788","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151773","6.2097","0.0007","13.1829","0.0014","15.2549","0.0018","90","","90.202","0.014","90","","1248.8","0.2","297","","297","1","","","","","","","see text","3","P 1 21 1","P 2yb","4","","","","- C14 H18 O3 -","- C14 H18 O3 -","- C56 H72 O12 -","4","2","","Schanderl, Martin; Jeong, Won Boo; Schwarz, Michael; Reiser, Oliver","Stereoselective rearrangement of guaianolides to tricyclic δ-valerolactones.","Organic & biomolecular chemistry","2011","9","7","2543","2547","10.1039/c0ob00919a","","","0.71073","MoKα","","0.1263","0.0456","","","0.0793","0.0969","","","","","","0.781","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151774","6.7923","0.0007","11.6086","0.0014","20.037","0.003","90","","90","","90","","1579.9","0.3","297","","297","1","","","","","","","see text","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 O5 -","- C16 H22 O5 -","- C64 H88 O20 -","4","1","","Schanderl, Martin; Jeong, Won Boo; Schwarz, Michael; Reiser, Oliver","Stereoselective rearrangement of guaianolides to tricyclic δ-valerolactones.","Organic & biomolecular chemistry","2011","9","7","2543","2547","10.1039/c0ob00919a","","","0.71073","MoKα","","0.1093","0.0439","","","0.0788","0.0946","","","","","","0.785","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151775","6.9797","0.0007","11.9507","0.0009","17.3512","0.0012","90","","90","","90","","1447.3","0.2","297","","297","1","","","","","","","see text","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 O4 -","- C16 H22 O4 -","- C64 H88 O16 -","4","1","","Schanderl, Martin; Jeong, Won Boo; Schwarz, Michael; Reiser, Oliver","Stereoselective rearrangement of guaianolides to tricyclic δ-valerolactones.","Organic & biomolecular chemistry","2011","9","7","2543","2547","10.1039/c0ob00919a","","","0.71073","MoKα","","0.0515","0.0415","","","0.1041","0.1087","","","","","","0.958","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151776","17.9518","0.0003","8.62335","0.00015","9.25071","0.00015","90","","96.1609","0.0015","90","","1423.78","0.04","123","","123","","","","","","","","see text","3","C 1 2 1","C 2y","5","","","","- C16 H22 O4 -","- C16 H22 O4 -","- C64 H88 O16 -","4","1","","Schanderl, Martin; Jeong, Won Boo; Schwarz, Michael; Reiser, Oliver","Stereoselective rearrangement of guaianolides to tricyclic δ-valerolactones.","Organic & biomolecular chemistry","2011","9","7","2543","2547","10.1039/c0ob00919a","","x-ray","1.54184","CuKα","","0.0298","0.0293","","","0.0815","0.0819","","","","","","1.078","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151777","38.963","0.016","9.07","0.004","25.863","0.011","90","","130.953","0.005","90","","6903","5","100","2","100","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C45 H33 N5 O3 -","- C45 H33 N5 O3 -","- C360 H264 N40 O24 -","8","1","","Akhigbe, Joshua; Peters, Gretchen; Zeller, Matthias; Brückner, Christian","Unexpected hydroxylamine-induced ring-closure reactions of meso-tetraphenylsecochlorin bisaldehyde.","Organic & biomolecular chemistry","2011","9","7","2306","2313","10.1039/c0ob00920b","","","0.71073","MoKα","","0.1951","0.0855","","","0.2202","0.2784","","","","","","0.961","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151778","6.334","0.002","10.352","0.003","12.149","0.004","94.288","0.005","99.895","0.005","101.107","0.005","765.2","0.4","100","2","100","2","","","","","","","","3","P -1","-P 1","2","","","","- C43 H29 N5 -","- C43.006 H29.006 N4.994 -","- C43.006 H29.006 N4.994 -","1","0.5","","Akhigbe, Joshua; Peters, Gretchen; Zeller, Matthias; Brückner, Christian","Unexpected hydroxylamine-induced ring-closure reactions of meso-tetraphenylsecochlorin bisaldehyde.","Organic & biomolecular chemistry","2011","9","7","2306","2313","10.1039/c0ob00920b","","","0.71073","MoKα","","0.1223","0.0615","","","0.1457","0.1625","","","","","","1.092","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151779","9.2025","0.0003","11.0726","0.0003","14.1584","0.0004","83.548","0.002","72.05","0.002","67.759","0.003","1270.33","0.07","153","2","153","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H26 Cl3 N5 O3 -","- C25 H26 Cl3 N5 O3 -","- C50 H52 Cl6 N10 O6 -","2","1","","Wu, Wei-Bin; Chen, Shu-Han; Hou, Jin-Qiang; Tan, Jia-Heng; Ou, Tian-Miao; Huang, Shi-Liang; Li, Ding; Gu, Lian-Quan; Huang, Zhi-Shu","Disubstituted 2-phenyl-benzopyranopyrimidine derivatives as a new type of highly selective ligands for telomeric G-quadruplex DNA.","Organic & biomolecular chemistry","2011","9","8","2975","2986","10.1039/c0ob00921k","","","1.5418","CuKα","","0.0335","0.0308","","","0.086","0.0894","","","","","","0.931","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151780","8.886","0.0009","8.1987","0.0008","13.9274","0.0013","90","","101.873","0.002","90","","992.95","0.17","223.1","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C12 H24 Cl2 I K O6 -","- C12 H24 Cl2 I K O6 -","- C24 H48 Cl4 I2 K2 O12 -","2","0.5","","Mbatia, Hannah W.; Ulloa, Olbelina A.; Kennedy, Daniel P.; Incarvito, Christopher D.; Burdette, Shawn C.","Iodination of anilines and phenols with 18-crown-6 supported ICl2-.","Organic & biomolecular chemistry","2011","9","8","2987","2991","10.1039/c0ob00926a","","","0.71075","MoKα","","","0.0344","","","","0.06","","","","","","1.124","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151781","7.8543","0.0006","9.3193","0.0007","10.5343","0.0006","95.589","0.004","110.786","0.002","95.62","0.004","710.15","0.09","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C28 H34 Br2 N4 O6 -","- C11.56 H15.15 Br0.8 N1.66 O2.52 -","- C23.12 H30.3 Br1.6 N3.32 O5.04 -","2","1","","Nour, Hany F.; Matei, Marius F.; Bassil, Bassem S.; Kortz, Ulrich; Kuhnert, Nikolai","Synthesis of tri-substituted biaryl based trianglimines: formation of C3-symmetrical and non-symmetrical regioisomers.","Organic & biomolecular chemistry","2011","9","9","3258","3271","10.1039/c0ob00944j","","","0.71073","MoKα","","0.0318","0.0274","","","0.0804","0.084","","","","","","1.003","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151782","9.102","0.002","18.341","0.005","32.012","0.008","90","","90","","90","","5344","2","294","2","294","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C31 H32 N3 O4.5 -","- C31 H32 N3 O4.5 -","- C248 H256 N24 O36 -","8","2","","Amat, Mercedes; Arróniz, Carlos; Molins, Elies; Escolano, Carmen; Bosch, Joan","Highly stereoselective double (R)-phenylglycinol-induced cyclocondensation reactions of symmetric aryl bis(oxoacids).","Organic & biomolecular chemistry","2011","9","7","2175","2184","10.1039/c0ob00970a","","x-ray","0.71073","MoKα","","0.2333","0.1037","","","0.2595","0.3356","","","","","","1.088","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151783","10.613","0.004","10.186","0.003","23.142","0.012","90","","91.9","0.04","90","","2500.4","1.8","294","2","294","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C29 H27 N3 O4 -","- C29 H27 N3 O4 -","- C116 H108 N12 O16 -","4","2","","Amat, Mercedes; Arróniz, Carlos; Molins, Elies; Escolano, Carmen; Bosch, Joan","Highly stereoselective double (R)-phenylglycinol-induced cyclocondensation reactions of symmetric aryl bis(oxoacids).","Organic & biomolecular chemistry","2011","9","7","2175","2184","10.1039/c0ob00970a","","x-ray","0.71073","MoKα","","0.0968","0.0653","","","0.1386","0.158","","","","","","1.119","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151784","9.727","0.003","9.727","0.003","25.904","0.032","90","","90","","90","","2451","3","294","2","294","2","","","","","","","synthesis as described","4","P 41 21 2","P 4abw 2nw","92","","","","- C15 H14 N O2 -","- C15 H14 N O2 -","- C120 H112 N8 O16 -","8","1","","Amat, Mercedes; Arróniz, Carlos; Molins, Elies; Escolano, Carmen; Bosch, Joan","Highly stereoselective double (R)-phenylglycinol-induced cyclocondensation reactions of symmetric aryl bis(oxoacids).","Organic & biomolecular chemistry","2011","9","7","2175","2184","10.1039/c0ob00970a","","x-ray","0.71073","MoKα","","0.1108","0.0542","","","0.1488","0.1717","","","","","","1.059","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151785","9.737","0.008","10.015","0.006","26.408","0.011","90","","90","","90","","2575","3","294","2","294","2","","","","","","","synthesis as described","4","P 21 21 21","P 2ac 2ab","19","","","","- C30 H30 N2 O4 -","- C30 H30 N2 O4 -","- C120 H120 N8 O16 -","4","1","","Amat, Mercedes; Arróniz, Carlos; Molins, Elies; Escolano, Carmen; Bosch, Joan","Highly stereoselective double (R)-phenylglycinol-induced cyclocondensation reactions of symmetric aryl bis(oxoacids).","Organic & biomolecular chemistry","2011","9","7","2175","2184","10.1039/c0ob00970a","","x-ray","0.71073","MoKα","","0.0894","0.0639","","","0.1898","0.2124","","","","","","1.124","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151786","5.559","0.006","8.894","0.004","12.507","0.006","90","","92.64","0.06","90","","617.7","0.8","294","2","294","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C14 H16 N2 O2 -","- C14 H16 N2 O2 -","- C28 H32 N4 O4 -","2","1","","Amat, Mercedes; Arróniz, Carlos; Molins, Elies; Escolano, Carmen; Bosch, Joan","Highly stereoselective double (R)-phenylglycinol-induced cyclocondensation reactions of symmetric aryl bis(oxoacids).","Organic & biomolecular chemistry","2011","9","7","2175","2184","10.1039/c0ob00970a","","x-ray","0.71073","MoKα","","0.1612","0.063","","","0.1355","0.1654","","","","","","0.869","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151787","6.9698","0.0002","9.4671","0.0003","17.75","0.0004","90","","94.399","0.002","90","","1167.76","0.06","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2-hydroxynaphtho(1,8-de)(1,3,2)dithiazine 1,1,3,3-tetraoxide monohydrate","2-hydroxynaphtho[1,8-de][1,3,2]dithiazine 1,1,3,3-tetraoxide monohydrate","","- C10 H9 N O6 S2 -","- C10 H9 N O6 S2 -","- C40 H36 N4 O24 S8 -","4","1","","Patel, Bhaven; Carlisle, Julie; Bottle, Steven E.; Hanson, Graeme R.; Kariuki, Benson M.; Male, Louise; McMurtrie, John C.; Spencer, Neil; Grainger, Richard S.","In search of a new class of stable nitroxide: synthesis and reactivity of a peri-substituted N,N-bissulfonylhydroxylamine.","Organic & biomolecular chemistry","2011","9","7","2336","2344","10.1039/c0ob00976h","","","0.71073","MoKα","","0.0645","0.0552","","","0.1506","0.1599","","","","","","1.082","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151788","14.1894","0.0003","7.1236","0.0002","18.0588","0.0004","90","","112.627","0.001","90","","1684.88","0.07","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","2-hydroxynaphtho(1,8-de)(1,3,2)dithiazine 1,1,3,3-tetraoxide ethyl acetate","2-hydroxynaphtho[1,8-de][1,3,2]dithiazine 1,1,3,3-tetraoxide ethyl acetate","","- C14 H15 N O7 S2 -","- C14 H15 N O7 S2 -","- C56 H60 N4 O28 S8 -","4","1","","Patel, Bhaven; Carlisle, Julie; Bottle, Steven E.; Hanson, Graeme R.; Kariuki, Benson M.; Male, Louise; McMurtrie, John C.; Spencer, Neil; Grainger, Richard S.","In search of a new class of stable nitroxide: synthesis and reactivity of a peri-substituted N,N-bissulfonylhydroxylamine.","Organic & biomolecular chemistry","2011","9","7","2336","2344","10.1039/c0ob00976h","","","1.54178","CuKα","","0.0515","0.0388","","","0.0992","0.1083","","","","","","1.04","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151789","15.1983","0.0015","8.5889","0.0007","15.6813","0.0015","90","","95.42","0.01","90","","2037.8","0.3","173","2","173","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","(Z)-1,1,3,3-tetraoxidonaphtho(1,8-d,e)(1,3,2)dithiazin-2-yl N- (2-cyanopropan-2-yl)isobutyimidate","(Z)-1,1,3,3-tetraoxidonaphtho[1,8-d,e][1,3,2]dithiazin-2-yl N-(2-cyanopropan-2-yl)isobutyimidate","","- C18 H19 N3 O5 S2 -","- C18 H19 N3 O5 S2 -","- C72 H76 N12 O20 S8 -","4","1","","Patel, Bhaven; Carlisle, Julie; Bottle, Steven E.; Hanson, Graeme R.; Kariuki, Benson M.; Male, Louise; McMurtrie, John C.; Spencer, Neil; Grainger, Richard S.","In search of a new class of stable nitroxide: synthesis and reactivity of a peri-substituted N,N-bissulfonylhydroxylamine.","Organic & biomolecular chemistry","2011","9","7","2336","2344","10.1039/c0ob00976h","","","0.71073","MoKα","","0.0732","0.0476","","","0.1021","0.1069","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151790","12.0422","0.0014","13.3971","0.0013","21.306","0.003","72.268","0.007","81.717","0.004","74.535","0.007","3148.1","0.7","120","2","120","2","","","","","","","","5","P -1","-P 1","2","4-butyl-2-hydroxynaphtho(1,8-de)(1,3,2)dithiazine 1,1,3,3- tetraoxide monohydrate","4-butyl-2-hydroxynaphtho[1,8-de][1,3,2]dithiazine 1,1,3,3-tetraoxide monohydrate","","- C14 H17 N O6 S2 -","- C14 H17 N O6 S2 -","- C112 H136 N8 O48 S16 -","8","4","","Patel, Bhaven; Carlisle, Julie; Bottle, Steven E.; Hanson, Graeme R.; Kariuki, Benson M.; Male, Louise; McMurtrie, John C.; Spencer, Neil; Grainger, Richard S.","In search of a new class of stable nitroxide: synthesis and reactivity of a peri-substituted N,N-bissulfonylhydroxylamine.","Organic & biomolecular chemistry","2011","9","7","2336","2344","10.1039/c0ob00976h","","","0.71073","MoKα","","0.2695","0.1509","","","0.2496","0.3157","","","","","","1.094","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151791","7.2877","0.0003","8.168","0.0003","8.3571","0.0002","93.74","0.002","107.823","0.002","92.785","0.002","471.35","0.03","120","2","120","2","","","","","","","","5","P -1","-P 1","2","N-hydroxy-O-benzenedisulfonimide monohydrate","N-hydroxy-O-benzenedisulfonimide monohydrate","","- C6 H7 N O6 S2 -","- C6 H7 N O6 S2 -","- C12 H14 N2 O12 S4 -","2","1","","Patel, Bhaven; Carlisle, Julie; Bottle, Steven E.; Hanson, Graeme R.; Kariuki, Benson M.; Male, Louise; McMurtrie, John C.; Spencer, Neil; Grainger, Richard S.","In search of a new class of stable nitroxide: synthesis and reactivity of a peri-substituted N,N-bissulfonylhydroxylamine.","Organic & biomolecular chemistry","2011","9","7","2336","2344","10.1039/c0ob00976h","","","0.71073","MoKα","","0.0465","0.0391","","","0.0871","0.0918","","","","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151792","10.8646","0.0011","12.0601","0.0011","20.4915","0.0018","90","","94.238","0.002","90","","2677.6","0.4","100","2","100","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C25 H24 Cl3 F3 N2 O3 S -","- C25 H24 Cl3 F3 N2 O3 S -","- C100 H96 Cl12 F12 N8 O12 S4 -","4","1","","Vicente, José; Chicote, María Teresa; Martínez-Martínez, Antonio Jesús; Bautista, Delia; Jones, Peter G.","Synthesis of a family of 3-alkyl- or 3-aryl-substituted 1,2-dihydroquinazolinium salts and their isomerization to 4-iminium-1,2,3,4-tetrahydroquinolines.","Organic & biomolecular chemistry","2011","9","7","2279","2285","10.1039/c0ob00982b","","","0.71073","MoKα","","0.0666","0.049","","","0.1024","0.1093","","","","","","1.061","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151793","17.6246","0.0014","12.9407","0.0011","20.1134","0.0017","90","","90","","90","","4587.4","0.7","100","2","100","2","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C24 H23 F3 N2 O3 S -","- C24 H23 F3 N2 O3 S -","- C192 H184 F24 N16 O24 S8 -","8","1","","Vicente, José; Chicote, María Teresa; Martínez-Martínez, Antonio Jesús; Bautista, Delia; Jones, Peter G.","Synthesis of a family of 3-alkyl- or 3-aryl-substituted 1,2-dihydroquinazolinium salts and their isomerization to 4-iminium-1,2,3,4-tetrahydroquinolines.","Organic & biomolecular chemistry","2011","9","7","2279","2285","10.1039/c0ob00982b","","","0.71073","MoKα","","0.1136","0.0837","","","0.203","0.2232","","","","","","1.029","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151794","10.9025","0.0011","13.0141","0.0013","13.1294","0.0014","90","","96.094","0.002","90","","1852.4","0.3","100","2","100","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C17 H23 F3 N2 O3 S -","- C17 H23 F3 N2 O3 S -","- C68 H92 F12 N8 O12 S4 -","4","1","","Vicente, José; Chicote, María Teresa; Martínez-Martínez, Antonio Jesús; Bautista, Delia; Jones, Peter G.","Synthesis of a family of 3-alkyl- or 3-aryl-substituted 1,2-dihydroquinazolinium salts and their isomerization to 4-iminium-1,2,3,4-tetrahydroquinolines.","Organic & biomolecular chemistry","2011","9","7","2279","2285","10.1039/c0ob00982b","","","0.71073","MoKα","","0.0592","0.0464","","","0.1106","0.1176","","","","","","1.028","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151795","13.531","0.002","17.185","0.002","19.511","0.002","108.267","0.013","106.724","0.013","101.091","0.014","3921.8","1.1","100","2","100","2","","","","","","","","7","P -1","-P 1","2","","","","- C75 H79 Cl8 F9 N6 O9 S3 -","- C75 H79 Cl8 F9 N6 O9 S3 -","- C150 H158 Cl16 F18 N12 O18 S6 -","2","1","","Vicente, José; Chicote, María Teresa; Martínez-Martínez, Antonio Jesús; Bautista, Delia; Jones, Peter G.","Synthesis of a family of 3-alkyl- or 3-aryl-substituted 1,2-dihydroquinazolinium salts and their isomerization to 4-iminium-1,2,3,4-tetrahydroquinolines.","Organic & biomolecular chemistry","2011","9","7","2279","2285","10.1039/c0ob00982b","","","1.54184","CuKα","","0.0942","0.0613","","","0.1666","0.1843","","","","","","0.987","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151796","11.8166","0.0017","16.328","0.002","13.928","0.002","90","","102.356","0.003","90","","2625","0.6","100","2","100","2","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C24 H28 Cl3 F3 N2 O3 S -","- C24 H28 Cl3 F3 N2 O3 S -","- C96 H112 Cl12 F12 N8 O12 S4 -","4","1","","Vicente, José; Chicote, María Teresa; Martínez-Martínez, Antonio Jesús; Bautista, Delia; Jones, Peter G.","Synthesis of a family of 3-alkyl- or 3-aryl-substituted 1,2-dihydroquinazolinium salts and their isomerization to 4-iminium-1,2,3,4-tetrahydroquinolines.","Organic & biomolecular chemistry","2011","9","7","2279","2285","10.1039/c0ob00982b","","","0.71073","MoKα","","0.1243","0.0959","","","0.1528","0.1627","","","","","","1.242","","","","has coordinates,has disorder","180303","2020-10-21","18:00:00",""
"7151797","8.6993","0.0017","10.744","0.002","11.593","0.002","75.65","0.03","74.28","0.03","86.28","0.03","1010.5","0.4","113","2","113","2","","","","","","","","6","P -1","-P 1","2","","","","- C21 H18 Cl2 N4 O2 Zn -","- C21 H18 Cl2 N4 O2 Zn -","- C42 H36 Cl4 N8 O4 Zn2 -","2","1","","Chen, Maliang; Lv, Xin; Liu, Yunlong; Zhao, Yun; Liu, Jing; Wang, Pi; Guo, Wei","An 2-(2'-aminophenyl)benzoxazole-based OFF-ON fluorescent chemosensor for Zn2+ in aqueous solution.","Organic & biomolecular chemistry","2011","9","7","2345","2349","10.1039/c0ob00983k","","","0.71073","MoKα","","0.038","0.0319","","","0.0946","0.1052","","","","","","1.022","","","","has coordinates","180303","2020-10-21","18:00:00",""
"7151798","18.7761","0.0016","18.7761","0.0016","43.329","0.004","90","","90","","120","","13229","2","100","2","100","2","","","","","","","","4","R -3 :H","-R 3","148","","","","- C9 H19 N O -","- C9 H19 N O -","- C486 H1026 N54 O54 -","54","3","","Giffin, Nick A.; Makramalla, Miller; Hendsbee, Arthur D.; Robertson, Katherine N.; Sherren, Cody; Pye, Cory C.; Masuda, Jason D.; Clyburne, Jason A. C.","Anhydrous TEMPO-H: reactions of a good hydrogen atom donor with low-valent carbon centres.","Organic & biomolecular chemistry","2011","9","10","3672","3680","10.1039/c0ob00999g","","","0.71073","MoKα","","0.0781","0.042","","","0.0861","0.0993","","","","","","1.096","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7151799","10.989","0.002","15.262","0.003","16.648","0.004","90","","94.25","0.003","90","","2784.4","1","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H43 N3 O -","- C30 H43 N3 O -","- C120 H172 N12 O4 -","4","1","","Giffin, Nick A.; Makramalla, Miller; Hendsbee, Arthur D.; Robertson, Katherine N.; Sherren, Cody; Pye, Cory C.; Masuda, Jason D.; Clyburne, Jason A. C.","Anhydrous TEMPO-H: reactions of a good hydrogen atom donor with low-valent carbon centres.","Organic & biomolecular chemistry","2011","9","10","3672","3680","10.1039/c0ob00999g","","","0.71073","MoKα","","0.0695","0.0475","","","0.114","0.1271","","","","","","1.025","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7151800","11.903","0.0013","12.1631","0.0013","18.1","0.002","90","","93.642","0.001","90","","2615.2","0.5","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C29 H34 N O2 P -","- C29 H34 N O2 P -","- C116 H136 N4 O8 P4 -","4","1","","Giffin, Nick A.; Makramalla, Miller; Hendsbee, Arthur D.; Robertson, Katherine N.; Sherren, Cody; Pye, Cory C.; Masuda, Jason D.; Clyburne, Jason A. C.","Anhydrous TEMPO-H: reactions of a good hydrogen atom donor with low-valent carbon centres.","Organic & biomolecular chemistry","2011","9","10","3672","3680","10.1039/c0ob00999g","","","0.71073","MoKα","","0.0591","0.0419","","","0.1017","0.1133","","","","","","1.02","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151801","10.2181","0.0007","19.3153","0.0014","19.5555","0.0014","90","","90","","90","","3859.6","0.5","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C42 H62 N2 O -","- C42 H62 N2 O -","- C168 H248 N8 O4 -","4","1","","Giffin, Nick A.; Makramalla, Miller; Hendsbee, Arthur D.; Robertson, Katherine N.; Sherren, Cody; Pye, Cory C.; Masuda, Jason D.; Clyburne, Jason A. C.","Anhydrous TEMPO-H: reactions of a good hydrogen atom donor with low-valent carbon centres.","Organic & biomolecular chemistry","2011","9","10","3672","3680","10.1039/c0ob00999g","","","0.71073","MoKα","","0.0675","0.0438","","","0.0945","0.1026","","","","","","0.956","","","","has coordinates,has disorder","180304","2020-10-21","18:00:00",""
"7151802","12.6312","0.0012","12.1657","0.0012","12.2949","0.0012","90","","109.24","0.002","90","","1783.8","0.3","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H15 N O2 -","- C25 H15 N O2 -","- C100 H60 N4 O8 -","4","1","","Liu, Yang; Huang, Liping; Xie, Fuchun; Chen, Xuxing; Hu, Youhong","Synthesis of novel functional polycyclic chromones through Michael addition and double cyclizations.","Organic & biomolecular chemistry","2011","9","8","2680","2684","10.1039/c0ob01000f","","","0.71073","MoKα","","0.0604","0.0502","","","0.1374","0.1443","","","","","","1.048","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151803","12.568","0.002","15.248","0.002","9.6494","0.0015","90","","98.182","0.003","90","","1830.4","0.5","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H19 N O2 -","- C23 H19 N O2 -","- C92 H76 N4 O8 -","4","1","","Liu, Yang; Huang, Liping; Xie, Fuchun; Chen, Xuxing; Hu, Youhong","Synthesis of novel functional polycyclic chromones through Michael addition and double cyclizations.","Organic & biomolecular chemistry","2011","9","8","2680","2684","10.1039/c0ob01000f","","","0.71073","MoKα","","0.1162","0.0568","","","0.1309","0.1479","","","","","","0.84","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151804","29.6523","0.001","17.5907","0.001","17.344","0.0007","90","","108.649","0.003","90","","8571.7","0.7","296","2","296","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cl2 N4 S -","- C14 H10 Cl2 N4 S -","- C336 H240 Cl48 N96 S24 -","24","3","","Yella, Ramesh; Khatun, Nilufa; Rout, Saroj Kumar; Patel, Bhisma K.","Tandem regioselective synthesis of tetrazoles and related heterocycles using iodine.","Organic & biomolecular chemistry","2011","9","9","3235","3245","10.1039/c0ob01007c","","","0.71073","MoKα","","0.1132","0.0345","","","0.1011","0.1412","","","","","","0.947","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151805","10.7905","0.0004","7.483","0.0003","11.7242","0.0004","90","","108.708","0.002","90","","896.66","0.06","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C7 H6 Cl N5 -","- C7 H6 Cl N5 -","- C28 H24 Cl4 N20 -","4","1","","Yella, Ramesh; Khatun, Nilufa; Rout, Saroj Kumar; Patel, Bhisma K.","Tandem regioselective synthesis of tetrazoles and related heterocycles using iodine.","Organic & biomolecular chemistry","2011","9","9","3235","3245","10.1039/c0ob01007c","","","0.71073","MoKα","","0.0726","0.0547","","","0.1932","0.2112","","","","","","1.022","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151806","7.3229","0.0002","9.8303","0.0003","10.161","0.0003","81.772","0.002","70.996","0.002","76.86","0.002","671.58","0.04","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C13 H9 Cl2 N5 -","- C13 H9 Cl2 N5 -","- C26 H18 Cl4 N10 -","2","1","","Yella, Ramesh; Khatun, Nilufa; Rout, Saroj Kumar; Patel, Bhisma K.","Tandem regioselective synthesis of tetrazoles and related heterocycles using iodine.","Organic & biomolecular chemistry","2011","9","9","3235","3245","10.1039/c0ob01007c","","","0.71073","MoKα","","0.0472","0.0406","","","0.1172","0.1242","","","","","","1.079","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151807","10.836","0.0004","16.3772","0.0006","7.6105","0.0003","90","","107.28","0.002","90","","1289.63","0.09","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 N5 O -","- C14 H13 N5 O -","- C56 H52 N20 O4 -","4","1","","Yella, Ramesh; Khatun, Nilufa; Rout, Saroj Kumar; Patel, Bhisma K.","Tandem regioselective synthesis of tetrazoles and related heterocycles using iodine.","Organic & biomolecular chemistry","2011","9","9","3235","3245","10.1039/c0ob01007c","","","0.71073","MoKα","","0.0672","0.0442","","","0.1203","0.1327","","","","","","0.953","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151808","29.6523","0.001","5.863","0.0003","17.344","0.0007","90","","108.649","0.003","90","","2857","0.2","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C14 H10 Cl2 N4 S -","- C14 H10 Cl2 N4 S -","- C112 H80 Cl16 N32 S8 -","8","1","","Yella, Ramesh; Khatun, Nilufa; Rout, Saroj Kumar; Patel, Bhisma K.","Tandem regioselective synthesis of tetrazoles and related heterocycles using iodine.","Organic & biomolecular chemistry","2011","9","9","3235","3245","10.1039/c0ob01007c","","","0.71073","MoKα","","0.04","0.0319","","","0.0735","0.0778","","","","","","0.988","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151809","5.1057","0.0005","10.2051","0.0012","40.956","0.004","90","","90","","90","","2134","0.4","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","methyl-2-(2-(tert-butoxycarbonylamino)-3-methylbutanamido)-3-phenylpropanoate","","","- C20 H30 N2 O5 -","- C20 H30 N2 O5 -","- C80 H120 N8 O20 -","4","1","","Maity, Sibaprasad; Kumar, Pankaj; Haldar, Debasish","An amyloid-like fibril-forming supramolecular cross-β-structure of a model peptide: a crystallographic insight.","Organic & biomolecular chemistry","2011","9","10","3787","3791","10.1039/c0ob01033b","","","0.71073","MoKα","","0.0694","0.0453","","","0.1091","0.1315","","","","","","0.938","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151810","13.0021","0.0013","7.2565","0.0007","14.3625","0.0015","90","","111.335","0.001","90","","1262.2","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","(E)-(2-chloro-3,4-dimethylpenta-1,3-dienyl)benzene","(E)-(2-chloro-3,4-dimethylpenta-1,3-dienyl)benzene","","- C13 H14 Cl N O2 -","- C12.5 H14 Cl N O2 -","- C50 H56 Cl4 N4 O8 -","4","1","","Gallego, Gary; Ariafard, Alireza; Tran, Kiet; Sandoval, David; Choi, Leera; Chen, Yi-Hsun; Yates, Brian F.; Tao, Fu-Ming; Hyland, Christopher J. T.","Titanium-mediated rearrangement of cyclopropenylmethyl acetates to (E)-halodienes.","Organic & biomolecular chemistry","2011","9","9","3359","3363","10.1039/c0ob01046d","","","0.71073","MoKα","","0.0866","0.0758","","","0.223","0.2348","","","","","","1.083","","","","has coordinates,has disorder","180304","2020-10-21","18:00:00",""
"7151811","5.4217","0.0002","20.2401","0.0009","40.725","0.0017","90","","91.593","0.001","90","","4467.3","0.3","120","2","120","2","","","","","","","","5","P 1 21 1","P 2yb","4","","1-((R)-2-chloro-2-phenylethyl)-5-(2-hydroxy-1-methoxyethyl)-N- -(4-methoxyphenethyl)-1H-pyrazolo[3,4-b]pyridin-4-amine","","- C25 H25 Cl N4 O3 -","- C25 H25 Cl N4 O3 -","- C200 H200 Cl8 N32 O24 -","8","4","","Tuccinardi, Tiziano; Zizzari, Alessandra Tania; Brullo, Chiara; Daniele, Simona; Musumeci, Francesca; Schenone, Silvia; Trincavelli, Maria Letizia; Martini, Claudia; Martinelli, Adriano; Giorgi, Gianluca; Botta, Maurizio","Substituted pyrazolo[3,4-b]pyridines as human A1 adenosine antagonists: Developments in understanding the receptor stereoselectivity","Organic & Biomolecular Chemistry","2011","9","12","4448","","10.1039/c0ob01064b","","","0.71073","MoKα","","0.2048","0.1084","","","0.1798","0.2254","","","","","","1.078","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151812","10.4285","0.0015","12.4428","0.0015","14.7188","0.0015","86.41","0.003","72.131","0.002","86.886","0.003","1813","0.4","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C42 H49 N O3 Si -","- C42 H49 N O3 Si -","- C84 H98 N2 O6 Si2 -","2","1","","Findley, Thomas J. K.; Sucunza, David; Miller, Laura C.; Helm, Matthew D.; Helliwell, Madeleine; Davies, David T.; Procter, David J.","A stereoselective, Sm(II)-mediated approach to decorated cis-hydrindanes: synthetic studies on faurinone and pleuromutilin.","Organic & biomolecular chemistry","2011","9","7","2433","2451","10.1039/c0ob01086c","","","0.71073","MoKα","","0.2302","0.0756","","","0.1387","0.1795","","","","","","0.775","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151813","11.96","0.002","16.344","0.003","7.655","0.002","90","","109.03","0.03","90","","1414.6","0.6","198","2","198","2","","","","","","","synthesis","4","C 1 c 1","C -2yc","9","","","","- C18 H17 N O -","- C18 H17 N O -","- C72 H68 N4 O4 -","4","1","","Gruner, Konstanze K.; Hopfmann, Thomas; Matsumoto, Kazuhiro; Jäger, Anne; Katsuki, Tsutomu; Knölker, Hans-Joachim","Efficient iron-mediated approach to pyrano[3,2-a]carbazole alkaloids‒first total syntheses of O-methylmurrayamine A and 7-methoxymurrayacine, first asymmetric synthesis and assignment of the absolute configuration of (-)-trans-dihydroxygirinimbine.","Organic & biomolecular chemistry","2011","9","7","2057","2061","10.1039/c0ob01088j","","x-ray","0.71073","MoKα","","0.0593","0.0375","","","0.0747","0.0811","","","","","","1.037","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151814","11.5224","0.0012","11.6757","0.0014","12.5624","0.0015","90","","90","","90","","1690","0.3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C13 H25 I O2 Si -","- C13 H25 I O2 Si -","- C52 H100 I4 O8 Si4 -","4","1","","Qi, Xian-Liang; Zhang, Jun-Tao; Feng, Jian-Peng; Cao, Xiao-Ping","Total synthesis and absolute configuration of malyngamide W.","Organic & biomolecular chemistry","2011","9","10","3817","3824","10.1039/c0ob01118e","","","0.71073","MoKα","","0.0368","0.0295","","","0.0669","0.0702","","","","","","1.039","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151815","6.7967","0.0002","12.1325","0.0003","12.4682","0.0003","69.546","0.001","81.774","0.001","85.665","0.001","953.04","0.04","100","2","100","2","","","","","","","","4","P -1","-P 1","2","Methyl 6-(3-nitrophenyl)-1,2,6,7-tetrahydroindolo(1,7-ab)(1,5)benzodiazepine-9-carboxylate","Methyl 6-(3-nitrophenyl)-1,2,6,7-tetrahydroindolo[1,7-ab][1,5]benzodiazepine-9-carboxylate","","- C23 H19 N3 O4 -","- C23 H19 N3 O4 -","- C46 H38 N6 O8 -","2","1","","Lin, Po-Tsung; Salunke, Deepak B.; Chen, Li-Hsun; Sun, Chung-Ming","Soluble polymer supported divergent synthesis of tetracyclic benzene-fused pyrazino/diazepino indoles: an advanced synthetic approach to bioactive scaffolds.","Organic & biomolecular chemistry","2011","9","8","2925","2937","10.1039/c0ob01126f","","","0.71073","MoKα","","0.0547","0.044","","","0.1376","0.1587","","","","","","1.055","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151816","10.1275","0.0004","19.1023","0.0007","8.0831","0.0003","90","","106.182","0.001","90","","1501.79","0.1","100","2","100","2","","","","","","","","4","P 1 c 1","P -2yc","7","Methyl 6,6-dimethyl-5,6-dihydroindolo(1,2-a)quinoxaline-3-carboxylate","Methyl 6,6-dimethyl-5,6-dihydroindolo[1,2-a]quinoxaline-3-carboxylate","","- C19 H18 N2 O2 -","- C19 H18 N2 O2 -","- C76 H72 N8 O8 -","4","2","","Lin, Po-Tsung; Salunke, Deepak B.; Chen, Li-Hsun; Sun, Chung-Ming","Soluble polymer supported divergent synthesis of tetracyclic benzene-fused pyrazino/diazepino indoles: an advanced synthetic approach to bioactive scaffolds.","Organic & biomolecular chemistry","2011","9","8","2925","2937","10.1039/c0ob01126f","","","0.71073","MoKα","","0.0344","0.0318","","","0.0912","0.1044","","","","","","1.15","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151817","6.6572","0.0009","9.8399","0.0008","12.3209","0.0015","102.795","0.008","99.112","0.011","105.356","0.009","738.47","0.16","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H20 O3 -","- C18 H20 O3 -","- C36 H40 O6 -","2","1","","Bradley, Stephen A.; Bresnan, Brian J.; Draper, Sylvia M.; Geraghty, Niall W. A.; Jeffares, Mark; McCabe, Thomas; McMurry, T Brian H; O'Brien, John E","Photochemical [2 + 2] cycloaddition reactions of 6-alkenyl-3-phenylcyclohex-2-en-1-ones: using biradical conformation control to account for exceptions to the ""rule of five"".","Organic & biomolecular chemistry","2011","9","8","2959","2968","10.1039/c0ob01131b","","","0.71073","MoKα","","0.1289","0.0513","","","0.1022","0.1254","","","","","","0.991","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151818","6.6266","0.0007","10.1023","0.001","12.3043","0.0011","90.769","0.008","96.613","0.01","103.792","0.008","793.91","0.14","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C19 H22 O3 -","- C19 H22 O3 -","- C38 H44 O6 -","2","1","","Bradley, Stephen A.; Bresnan, Brian J.; Draper, Sylvia M.; Geraghty, Niall W. A.; Jeffares, Mark; McCabe, Thomas; McMurry, T Brian H; O'Brien, John E","Photochemical [2 + 2] cycloaddition reactions of 6-alkenyl-3-phenylcyclohex-2-en-1-ones: using biradical conformation control to account for exceptions to the ""rule of five"".","Organic & biomolecular chemistry","2011","9","8","2959","2968","10.1039/c0ob01131b","","","0.71073","MoKα","","0.0523","0.0373","","","0.0919","0.1003","","","","","","1.086","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151819","6.121","0.006","10.219","0.003","12.1028","0.0018","80.995","0.017","83.01","0.03","82.18","0.05","736.8","0.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C17 H18 O3 -","- C17 H18 O3 -","- C34 H36 O6 -","2","1","","Bradley, Stephen A.; Bresnan, Brian J.; Draper, Sylvia M.; Geraghty, Niall W. A.; Jeffares, Mark; McCabe, Thomas; McMurry, T Brian H; O'Brien, John E","Photochemical [2 + 2] cycloaddition reactions of 6-alkenyl-3-phenylcyclohex-2-en-1-ones: using biradical conformation control to account for exceptions to the ""rule of five"".","Organic & biomolecular chemistry","2011","9","8","2959","2968","10.1039/c0ob01131b","","","0.71073","MoKα","","0.1294","0.0527","","","0.1029","0.1273","","","","","","1.033","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151820","17.683","0.004","10.819","0.002","10.206","0.002","90","","114.81","0.03","90","","1772.3","0.8","293","2","293","2","","","","","","","","3","C 1 c 1","C -2yc","9","","","","- C21 H22 O3 -","- C21 H22 O3 -","- C84 H88 O12 -","4","1","","Wu, Yan-Chao; Li, Hui-Jing; Liu, Li; Liu, Zhe; Wang, Dong; Chen, Yong-Jun","Cascade reaction of β,γ-unsaturated α-ketoesters with phenols in trityl chloride/TFA system. Highly selective synthesis of 4-aryl-2H-chromenes and their applications.","Organic & biomolecular chemistry","2011","9","8","2868","2877","10.1039/c0ob01143f","","","0.71073","MoKα","","0.0905","0.0698","","","0.1715","0.1823","","","","","","1.017","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151821","14.3688","0.0008","7.7163","0.0004","18.1469","0.0011","90","","111.567","0.002","90","","1871.15","0.18","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 O4 -","- C21 H22 O4 -","- C84 H88 O16 -","4","1","","Wu, Yan-Chao; Li, Hui-Jing; Liu, Li; Liu, Zhe; Wang, Dong; Chen, Yong-Jun","Cascade reaction of β,γ-unsaturated α-ketoesters with phenols in trityl chloride/TFA system. Highly selective synthesis of 4-aryl-2H-chromenes and their applications.","Organic & biomolecular chemistry","2011","9","8","2868","2877","10.1039/c0ob01143f","","","0.71073","MoKα","","0.1399","0.0521","","","0.1209","0.1338","","","","","","0.673","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151822","6.0368","0.0012","13.398","0.003","29.789","0.006","90","","90","","90","","2409.4","0.9","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C28 H29 N O3 -","- C28 H29 N O3 -","- C112 H116 N4 O12 -","4","1","","Wu, Yan-Chao; Li, Hui-Jing; Liu, Li; Liu, Zhe; Wang, Dong; Chen, Yong-Jun","Cascade reaction of β,γ-unsaturated α-ketoesters with phenols in trityl chloride/TFA system. Highly selective synthesis of 4-aryl-2H-chromenes and their applications.","Organic & biomolecular chemistry","2011","9","8","2868","2877","10.1039/c0ob01143f","","","0.71073","MoKα","","0.0698","0.0436","","","0.1095","0.1307","","","","","","1.01","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151823","10.4109","0.0005","11.0028","0.0004","11.3302","0.0005","106.305","0.002","94.754","0.002","103.828","0.002","1193.8","0.09","302","","302","","","","","","","","","4","P 1","P 1","1","","Cbz-(Leu-Leu-Aib)2-OMe","","- C41 H68 N6 O9 -","- C41 H68 N6 O9 -","- C41 H68 N6 O9 -","1","1","","Demizu, Yosuke; Doi, Mitsunobu; Kurihara, Masaaki; Okuda, Haruhiro; Nagano, Masanobu; Suemune, Hiroshi; Tanaka, Masakazu","Conformational studies on peptides containing α,α-disubstituted α-amino acids: chiral cyclic α,α-disubstituted α-amino acid as an α-helical inducer.","Organic & biomolecular chemistry","2011","9","9","3303","3312","10.1039/c0ob01146k","","","0.71073","MoKα","","0.0534","0.0434","","","0.087","0.0905","","","","","","1.576","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151824","11.5605","0.0012","45.42","0.005","15.286","0.0016","90","","95.515","0.002","90","","7989.2","1.5","100","2","100","2","","","","","","","synthesis","4","P 1 21 1","P 2yb","4","Boc-(Leu-Leu-RR)3-OMe","Boc-(Leu-Leu-RR)3-OMe","","- C133 H248 N18 O42 -","- C133 H248 N18 O42 -","- C266 H496 N36 O84 -","2","1","","Demizu, Yosuke; Doi, Mitsunobu; Kurihara, Masaaki; Okuda, Haruhiro; Nagano, Masanobu; Suemune, Hiroshi; Tanaka, Masakazu","Conformational studies on peptides containing α,α-disubstituted α-amino acids: chiral cyclic α,α-disubstituted α-amino acid as an α-helical inducer.","Organic & biomolecular chemistry","2011","9","9","3303","3312","10.1039/c0ob01146k","","","0.71073","MoKα","","0.097","0.0859","","","0.237","0.2503","","","","","","1.096","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151825","12.9034","0.0012","14.8243","0.0013","16.6694","0.0015","104.879","0.001","93.483","0.002","112.918","0.001","2791.8","0.4","200","2","200","2","","","","","","","synthesis","4","P 1","P 1","1","","Cbz-[Leu-Leu-(S,S)-Ac5cdOM]2-OMe","","- C49.5 H83 N6 O14 -","- C49.5 H83 N6 O14 -","- C99 H166 N12 O28 -","2","2","","Demizu, Yosuke; Doi, Mitsunobu; Kurihara, Masaaki; Okuda, Haruhiro; Nagano, Masanobu; Suemune, Hiroshi; Tanaka, Masakazu","Conformational studies on peptides containing α,α-disubstituted α-amino acids: chiral cyclic α,α-disubstituted α-amino acid as an α-helical inducer.","Organic & biomolecular chemistry","2011","9","9","3303","3312","10.1039/c0ob01146k","","","0.71073","MoKα","","0.0574","0.0522","","","0.1427","0.1493","","","","","","1.01","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7151826","15.4487","0.0014","44.175","0.004","21.6774","0.0019","90","","96.234","0.002","90","","14706","2","240","2","240","2","","","","","","","synthesis","4","P 1 21 1","P 2yb","4","","Boc-(Leu-Leu-Acp)3-OMe","","- C60.5 H109.5 N9 O13.75 -","- C60.5 H109.5 N9 O13.75 -","- C484 H876 N72 O110 -","8","4","","Demizu, Yosuke; Doi, Mitsunobu; Kurihara, Masaaki; Okuda, Haruhiro; Nagano, Masanobu; Suemune, Hiroshi; Tanaka, Masakazu","Conformational studies on peptides containing α,α-disubstituted α-amino acids: chiral cyclic α,α-disubstituted α-amino acid as an α-helical inducer.","Organic & biomolecular chemistry","2011","9","9","3303","3312","10.1039/c0ob01146k","","","0.71073","MoKα","","0.1191","0.0962","","","0.2635","0.2857","","","","","","1.096","","","","has coordinates,has disorder","180304","2020-10-21","18:00:00",""
"7151827","11.2484","0.0009","8.5765","0.0005","12.9938","0.0009","90","","105.921","0.003","90","","1205.45","0.15","120.1","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C15 H20 O3 -","- C15 H20 O3 -","- C60 H80 O12 -","4","1","","Thornton, Paul D.; Cameron, T. Stanley; Burnell, D. Jean","Vinylogous anionic processes in the formation and interconversion of tetracyclic ring systems.","Organic & biomolecular chemistry","2011","9","9","3447","3456","10.1039/c0ob01152e","","","0.7107","MoKα","","","0.0364","","","","0.0452","","","","","","1.014","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151828","8.5532","0.0017","18.428","0.005","8.108","0.0017","93.05","0.02","118.249","0.014","94.88","0.02","1115.3","0.5","296.1","","296.1","","","","","","","","","3","P -1","-P 1","2","","","","- C14 H16 O2 -","- C14 H16 O2 -","- C56 H64 O8 -","4","2","","Thornton, Paul D.; Cameron, T. Stanley; Burnell, D. Jean","Vinylogous anionic processes in the formation and interconversion of tetracyclic ring systems.","Organic & biomolecular chemistry","2011","9","9","3447","3456","10.1039/c0ob01152e","","","0.71069","MoKα","","","0.0448","","","","0.0563","","","","","","1.127","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151829","8.3858","0.0002","8.9432","0.0004","16.6524","0.0014","82.616","0.011","76.245","0.009","83.941","0.014","1199.33","0.13","120.1","","","","","","","","","","","3","P -1","-P 1","2","","","","- C15 H18 O2 -","- C15 H18 O2 -","- C60 H72 O8 -","4","2","","Thornton, Paul D.; Cameron, T. Stanley; Burnell, D. Jean","Vinylogous anionic processes in the formation and interconversion of tetracyclic ring systems.","Organic & biomolecular chemistry","2011","9","9","3447","3456","10.1039/c0ob01152e","","","0.7107","MoKα","","","0.0442","","","","0.0555","","","","","","1.051","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151830","5.805","0.004","10.234","0.006","13.495","0.008","69.524","0.007","88.465","0.014","89.34","0.013","750.8","0.8","298","","298","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H17 N O2 S -","- C17 H17 N O2 S -","- C34 H34 N2 O4 S2 -","2","1","","Rao, R. Mohan; Reddy, Upendar C. H.; Alinakhi,; Mulakayala, Naveen; Alvala, Mallika; Arunasree, M. K.; Poondra, Rajamohan R.; Iqbal, Javed; Pal, Manojit","Sequential coupling/desilylation-coupling/cyclization in a single pot under Pd/C-Cu catalysis: synthesis of 2-(hetero)aryl indoles.","Organic & biomolecular chemistry","2011","9","10","3808","3816","10.1039/c0ob01161d","","","0.7107","MoKα","","","0.0574","","","","0.0603","","","","","","1.089","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151831","6.0736","0.0003","11.6934","0.0005","17.749","0.0009","74.4693","0.0012","86.7204","0.0013","73.3481","0.0013","1163.33","0.1","103.1","","103.1","","","","","","","","","5","P -1","-P 1","2","","","","- C27 H17 Cl2 N Se2 -","- C27 H17 Cl2 N Se2 -","- C54 H34 Cl4 N2 Se4 -","2","1","","Mitamura, Takenori; Iwata, Kimiyo; Nomoto, Akihiro; Ogawa, Akiya","Photochemical intramolecular cyclization of o-alkynylaryl isocyanides with organic dichalcogenides leading to 2,4-bischalcogenated quinolines.","Organic & biomolecular chemistry","2011","9","10","3768","3775","10.1039/c0ob01168a","","","0.71075","MoKα","","","0.0582","","","","0.1941","","","","","","1.005","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151832","6.3831","0.0014","7.837","0.003","15.41","0.003","90","","90.91","0.03","90","","770.8","0.4","130","2","130","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C14 H14 N4 O7 -","- C14 H14 N4 O7 -","- C28 H28 N8 O14 -","2","1","","Goeschen, Catrin; Wibowo, Natalia; White, Jonathan M.; Wille, Uta","Damage of aromatic amino acids by the atmospheric free radical oxidant NO3˙ in the presence of NO2˙, N2O4, O3 and O2.","Organic & biomolecular chemistry","2011","9","9","3380","3385","10.1039/c0ob01186j","","","1.54184","CuKα","","0.2038","0.057","","","0.062","0.0838","","","","","","0.615","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151833","9.5128","0.0008","7.9036","0.0007","12.3434","0.001","90","","109.552","0.001","90","","874.53","0.13","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C21 H26 O3 -","- C21 H26 O3 -","- C42 H52 O6 -","2","1","","Zhou, Bing; Li, Xiaomei; Tang, Huanyu; Miao, Zehong; Feng, Huijin; Li, Yuanchao","Total synthesis of novel D-ring-modified triptolide analogues: structure-cytotoxic activity relationship studies on the D-ring of triptolide.","Organic & biomolecular chemistry","2011","9","9","3176","3179","10.1039/c0ob01239d","","","0.71073","MoKα","","0.0493","0.0472","","","0.1288","0.1314","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151834","9.3443","0.0007","11.4954","0.0008","16.1665","0.0011","90","","90","","90","","1736.5","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H22 O6 -","- C20 H22 O6 -","- C80 H88 O24 -","4","1","","Zhou, Bing; Li, Xiaomei; Tang, Huanyu; Miao, Zehong; Feng, Huijin; Li, Yuanchao","Total synthesis of novel D-ring-modified triptolide analogues: structure-cytotoxic activity relationship studies on the D-ring of triptolide.","Organic & biomolecular chemistry","2011","9","9","3176","3179","10.1039/c0ob01239d","","","0.71073","MoKα","","0.041","0.039","","","0.1035","0.1055","","","","","","1.021","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151835","6.1705","0.0007","7.7879","0.0008","18.703","0.003","90","","94.971","0.007","90","","895.4","0.2","296","2","296","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12.67 H12 N O2 S -","- C12 H12 N1.33333 O2.66667 S1.33333 -","- C36 H36 N4 O8 S4 -","3","0.75","","Dhara, Kalyan; Paladhi, Sushovan; Midya, Ganesh Chandra; Dash, Jyotirmayee","Synthesis of spirocyclic thiazolidinediones using ring-closing metathesis and one-pot sequential ring-closing/cross metathesis.","Organic & biomolecular chemistry","2011","9","10","3801","3807","10.1039/c0ob01248c","","","0.71073","MoKα","","0.0565","0.039","","","0.103","0.1138","","","","","","1.044","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151836","13.741","0.004","6.0599","0.0016","17.805","0.005","90","","109.656","0.003","90","","1396.2","0.7","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C16 H16 O4 -","- C16 H16 O4 -","- C64 H64 O16 -","4","1","","Hu, Jie; Liu, Lei; Yang, Shangdong; Liang, Yong-Min","Phase-transfer-catalyzed cyclization reaction of nucleophilic addition to electron-deficient 1,3-conjugated enynes for the synthesis of functionalized 4H-pyrans.","Organic & biomolecular chemistry","2011","9","9","3375","3379","10.1039/c0ob01255f","","","0.71073","MoKα","","0.1041","0.0563","","","0.1282","0.1552","","","","","","1.031","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151837","9.0854","0.0018","13.43","0.003","13.56","0.003","96.34","0.03","107.73","0.03","102.33","0.03","1512","0.7","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C36 H32 O P -","- C36 H32 O P -","- C72 H64 O2 P2 -","2","1","","Cinar, Mehmet Emin; Vavilala, Chandrasekhar; Fan, Jian; Schmittel, Michael","The thermal C2-C6/[2 + 2] cyclisation of enyne-allenes: reversible diradical formation.","Organic & biomolecular chemistry","2011","9","10","3776","3779","10.1039/c0ob01275k","","","0.71073","MoKα","","0.175","0.0501","","","0.1118","0.1455","","","","","","0.723","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7151838","10.5465","0.0015","13.646","0.002","14.694","0.002","90","","90","","90","","2114.7","0.5","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C23 H22 Br N O3 -","- C23 H22 Br N O3 -","- C92 H88 Br4 N4 O12 -","4","1","","Yang, Yuan-Liang; Pei, Cheng-Kui; Shi, Min","Multifunctional chiral phosphines-catalyzed highly diastereoselective and enantioselective substitution of Morita-Baylis-Hillman adducts with oxazolones.","Organic & biomolecular chemistry","2011","9","9","3349","3358","10.1039/c1ob00017a","","","0.71073","MoKα","","0.0961","0.0406","","","0.0835","0.0952","","","","","","0.903","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151839","27.513","0.003","12.2721","0.0011","12.3143","0.0011","90","","90","","90","","4157.8","0.7","297","2","297","2","","","","","","","","4","P 21 21 2","P 2 2ab","18","","","","- C26 H18 N4 O2 -","- C26 H18 N4 O2 -","- C156 H108 N24 O12 -","6","1.5","","Yang, Li; Yang, Fei; Lan, Jingbo; Gao, Ge; You, Jingsong; Su, Xiaoyu","Rational design of BINOL-based diimidazolyl ligands: homochiral channel-like mono-component organic frameworks by hydrogen-bond-directed self-assembly.","Organic & biomolecular chemistry","2011","9","8","2618","2621","10.1039/c1ob00026h","","x-ray","0.71073","MoKα","","0.1438","0.0844","","","0.2112","0.2554","","","","","","1.125","","","","has coordinates","198633","2020-10-21","18:00:00",""
"7151840","9.261","0.0003","16.4271","0.0005","19.8316","0.0004","90","","90","","90","","3017.01","0.15","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C33 H33 N5 O5 -","- C33 H33 N5 O5 -","- C132 H132 N20 O20 -","4","1","","Yang, Li; Yang, Fei; Lan, Jingbo; Gao, Ge; You, Jingsong; Su, Xiaoyu","Rational design of BINOL-based diimidazolyl ligands: homochiral channel-like mono-component organic frameworks by hydrogen-bond-directed self-assembly.","Organic & biomolecular chemistry","2011","9","8","2618","2621","10.1039/c1ob00026h","","x-ray","0.71073","MoKα","","0.0694","0.0624","","","0.1703","0.1774","","","","","","1.09","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151841","11.95","0.002","11.95","0.002","21.08","0.006","90","","90","","90","","3010.3","1.1","297","2","297","2","","","","","","","","4","P 43","P 4cw","78","","","","- C26 H18 N4 O2 -","- C26 H18 N4 O2 -","- C104 H72 N16 O8 -","4","1","","Yang, Li; Yang, Fei; Lan, Jingbo; Gao, Ge; You, Jingsong; Su, Xiaoyu","Rational design of BINOL-based diimidazolyl ligands: homochiral channel-like mono-component organic frameworks by hydrogen-bond-directed self-assembly.","Organic & biomolecular chemistry","2011","9","8","2618","2621","10.1039/c1ob00026h","","x-ray","0.71073","MoKα","","0.0838","0.077","","","0.2107","0.2197","","","","","","1.101","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151842","5.8677","0.0008","12.9406","0.0018","14.433","0.002","90","","94.076","0.002","90","","1093.1","0.3","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H11 F2 N O2 -","- C12 H11 F2 N O2 -","- C48 H44 F8 N4 O8 -","4","1","","Chen, Zixian; Zhu, Jiangtao; Xie, Haibo; Li, Shan; Wu, Yongming; Gong, Yuefa","A cascade process for the synthesis of gem-difluoromethylene compounds.","Organic & biomolecular chemistry","2011","9","10","3878","3885","10.1039/c1ob00027f","","","0.71073","MoKα","","0.0668","0.05","","","0.1327","0.1407","","","","","","1.008","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151843","4.7575","0.0002","9.8672","0.0004","16.6178","0.0006","90","","92.21","0.002","90","","779.51","0.05","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C17 H21 Br O -","- C17 H21 Br O -","- C34 H42 Br2 O2 -","2","1","","Bondalapati, Somasekhar; Reddy, Udagandla C.; Saha, Pipas; Saikia, Anil K.","An efficient synthesis of dihydro- and tetrahydropyrans via oxonium-ene cyclization reaction.","Organic & biomolecular chemistry","2011","9","9","3428","3438","10.1039/c1ob00033k","","","0.71073","MoKα","","0.0605","0.0525","","","0.1308","0.1449","","","","","","1.077","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151844","9.8247","0.0005","11.1954","0.0006","16.1562","0.0009","101.883","0.003","95.733","0.003","91.65","0.003","1728.04","0.16","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H20 O4 S -","- C19 H20 O4 S -","- C76 H80 O16 S4 -","4","2","","Bondalapati, Somasekhar; Reddy, Udagandla C.; Saha, Pipas; Saikia, Anil K.","An efficient synthesis of dihydro- and tetrahydropyrans via oxonium-ene cyclization reaction.","Organic & biomolecular chemistry","2011","9","9","3428","3438","10.1039/c1ob00033k","","","0.71073","MoKα","","0.0798","0.0514","","","0.1409","0.1578","","","","","","1.007","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151845","11.6207","0.0012","19.274","0.002","16.3163","0.0015","90","","100.451","0.007","90","","3593.9","0.6","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C19 H20 N2 O4 -","- C19 H20 N2 O4 -","- C152 H160 N16 O32 -","8","2","","Bondalapati, Somasekhar; Reddy, Udagandla C.; Saha, Pipas; Saikia, Anil K.","An efficient synthesis of dihydro- and tetrahydropyrans via oxonium-ene cyclization reaction.","Organic & biomolecular chemistry","2011","9","9","3428","3438","10.1039/c1ob00033k","","","0.71073","MoKα","","0.0988","0.0522","","","0.118","0.1411","","","","","","1.003","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151846","4.093","0.0008","5.6694","0.0011","28.901","0.006","90","","91.42","0.03","90","","670.4","0.2","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H8 Br2 F2 O2 -","- C14 H8 Br2 F2 O2 -","- C28 H16 Br4 F4 O4 -","2","0.5","","Moody, Justin D.; VanDerveer, Don; Smith Jr., Dennis W.; Iacono, Scott T.","Synthesis of internal fluorinated alkenes via facile aryloxylation of substituted phenols with aryl trifluorovinyl ethers","Organic & Biomolecular Chemistry","2011","9","13","4842","","10.1039/c1ob05041a","","","0.71073","MoKα","","0.0356","0.0315","","","0.0663","0.0688","","","","","","1.118","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151847","12.711","0.003","4.8861","0.001","11.507","0.002","90","","96.33","0.03","90","","710.3","0.3","153","2","153","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H9 Br2 F3 O2 -","- C14 H9 Br2 F3 O2 -","- C28 H18 Br4 F6 O4 -","2","0.5","","Moody, Justin D.; VanDerveer, Don; Smith Jr., Dennis W.; Iacono, Scott T.","Synthesis of internal fluorinated alkenes via facile aryloxylation of substituted phenols with aryl trifluorovinyl ethers","Organic & Biomolecular Chemistry","2011","9","13","4842","","10.1039/c1ob05041a","","","0.71073","MoKα","","0.0346","0.0325","","","0.0833","0.0851","","","","","","1.148","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151848","10.434","0.002","7.7903","0.0016","17.852","0.004","90","","90","","90","","1451.1","0.5","153","2","153","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C16 H14 F2 O4 -","- C16 H14 F2 O4 -","- C64 H56 F8 O16 -","4","0.5","","Moody, Justin D.; VanDerveer, Don; Smith Jr., Dennis W.; Iacono, Scott T.","Synthesis of internal fluorinated alkenes via facile aryloxylation of substituted phenols with aryl trifluorovinyl ethers","Organic & Biomolecular Chemistry","2011","9","13","4842","","10.1039/c1ob05041a","","","0.71073","MoKα","","0.1011","0.0875","","","0.2396","0.2567","","","","","","1.086","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151849","12.696","0.002","12.411","0.002","20.491","0.004","90","","103.912","0.009","90","","3134.1","0.9","100","2","100","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C30 H32 N10 O7 S -","- C30 H32 N10 O7 S -","- C120 H128 N40 O28 S4 -","4","1","","Pramanik, Avijit; Thompson, Bethtrice; Hayes, Trina; Tucker, Kimberly; Powell, Douglas R.; Bonnesen, Peter V.; Ellis, Erick D.; Lee, Ken S.; Yu, Hongtao; Hossain, Md. Alamgir","Seven-coordinate anion complex with a tren-based urea: Binding discrepancy of hydrogen sulfate in solid and solution states","Organic & Biomolecular Chemistry","2011","9","12","4444","","10.1039/c1ob05052d","","","0.71073","MoKα","","0.1064","0.0587","","","0.1188","0.1367","","","","","","1.003","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151850","8.7312","0.0011","12.84","0.0017","13.682","0.0018","91.989","0.003","107.888","0.002","100.753","0.002","1427.1","0.3","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C30 H30 N10 O3 -","- C30 H30 N10 O3 -","- C60 H60 N20 O6 -","2","1","","Pramanik, Avijit; Thompson, Bethtrice; Hayes, Trina; Tucker, Kimberly; Powell, Douglas R.; Bonnesen, Peter V.; Ellis, Erick D.; Lee, Ken S.; Yu, Hongtao; Hossain, Md. Alamgir","Seven-coordinate anion complex with a tren-based urea: Binding discrepancy of hydrogen sulfate in solid and solution states","Organic & Biomolecular Chemistry","2011","9","12","4444","","10.1039/c1ob05052d","","","0.71073","MoKα","","0.0699","0.0495","","","0.1166","0.1273","","","","","","1.003","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151851","8.8268","0.0018","8.9764","0.0018","16.501","0.003","99.27","0.03","96.72","0.03","118.09","0.03","1110.1","0.6","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C12 H13 N3 -","- C12 H13 N3 -","- C48 H52 N12 -","4","2","","Zheng, Zisheng; Tang, Lina; Fan, Yanfeng; Qi, Xiuxiang; Du, Yunfei; Zhang-Negrerie, Daisy","Oxidative aromatic C-N bond formation: convenient synthesis of N-amino-3-nitrile-indoles via FeBr3-mediated intramolecular cyclization.","Organic & biomolecular chemistry","2011","9","10","3714","3725","10.1039/c1ob05069a","","","0.71073","MoKα","","0.1123","0.0535","","","0.1461","0.21","","","","","","1.069","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151852","12.9167","0.0017","9.8437","0.0013","13.3798","0.0017","90","","107.208","0.002","90","","1625.1","0.4","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H18 O4 -","- C19 H18 O4 -","- C76 H72 O16 -","4","1","","Han, Xingchun; Jiang, Liqing; Tang, Min; Hu, Wenhao","Diastereoselective three-component reactions of aryldiazoacetates with alcohols/water and alkynals: application to substituted enelactones.","Organic & biomolecular chemistry","2011","9","10","3839","3843","10.1039/c1ob05076a","","","0.71073","MoKα","","0.0668","0.0443","","","0.0955","0.1038","","","","","","0.93","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151853","10.4347","0.0008","15.9131","0.0012","14.1048","0.001","90","","109.487","0.001","90","","2207.9","0.3","293","2","293","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C12 H12 O4 -","- C12 H12 O4 -","- C96 H96 O32 -","8","1","","Han, Xingchun; Jiang, Liqing; Tang, Min; Hu, Wenhao","Diastereoselective three-component reactions of aryldiazoacetates with alcohols/water and alkynals: application to substituted enelactones.","Organic & biomolecular chemistry","2011","9","10","3839","3843","10.1039/c1ob05076a","","","0.71073","MoKα","","0.0483","0.0448","","","0.1267","0.1299","","","","","","1.057","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151854","11.5596","0.0006","9.9041","0.0005","13.9757","0.0007","90","","91.254","0.004","90","","1599.66","0.14","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H16 Cl N -","- C21 H16 Cl N -","- C84 H64 Cl4 N4 -","4","1","","Khlebnikov, Alexander F.; Novikov, Mikhail S.; Golovkina, Maria V.; Petrovskii, Petr P.; Konev, Alexander S.; Yufit, Dmitry S.; Stoeckli-Evans, Helen","An efficient approach to azirino and pyrrolo-fused dibenzazepines. Conformations of substituted dibenzo[c,f]pyrrolo[1,2-a]azepines.","Organic & biomolecular chemistry","2011","9","10","3886","3895","10.1039/c1ob05081h","","","0.71073","MoKα","","0.0458","0.0383","","","0.0922","0.0957","","","","","","1.054","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151855","10.071","0.0002","25.9843","0.0005","17.0032","0.0003","90","","104.46","0.01","90","","4308.6","0.2","120","","120","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","Dimethyl (1RS,2RS,3RS,13bRS)-3-phenyl-2,3,9,13b-tetrahydro-1H -dibenzo[c,f]pyrrolo[1,2-a]azepine-1,2-dicarboxylate","","- C27 H25 N O4 -","- C27 H25 N O4 -","- C216 H200 N8 O32 -","8","2","","Khlebnikov, Alexander F.; Novikov, Mikhail S.; Golovkina, Maria V.; Petrovskii, Petr P.; Konev, Alexander S.; Yufit, Dmitry S.; Stoeckli-Evans, Helen","An efficient approach to azirino and pyrrolo-fused dibenzazepines. Conformations of substituted dibenzo[c,f]pyrrolo[1,2-a]azepines.","Organic & biomolecular chemistry","2011","9","10","3886","3895","10.1039/c1ob05081h","","","0.71073","MOKα","","0.0965","0.0458","","","0.0851","0.0949","","","","","","0.988","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151856","36.9379","0.0014","28.7704","0.0011","15.802","0.0006","90","","113.74","0.01","90","","15372.1","1.6","120","","120","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","(1RS,2SR,3SR,13bRS)-3-Phenyl-2,3,9,13b-tetrahydro-1H-dibenzo[c,f]pyrrolo [1,2-a]azepine-1,2-dicarbonitrile","","- C25.06 H19.13 Cl0.13 N3 -","- C25.0625 H19.125 Cl0.125 N3 -","- C802 H612 Cl4 N96 -","32","4","","Khlebnikov, Alexander F.; Novikov, Mikhail S.; Golovkina, Maria V.; Petrovskii, Petr P.; Konev, Alexander S.; Yufit, Dmitry S.; Stoeckli-Evans, Helen","An efficient approach to azirino and pyrrolo-fused dibenzazepines. Conformations of substituted dibenzo[c,f]pyrrolo[1,2-a]azepines.","Organic & biomolecular chemistry","2011","9","10","3886","3895","10.1039/c1ob05081h","","","0.71073","MOKα","","0.1394","0.0606","","","0.1357","0.1546","","","","","","0.95","","","","has coordinates,has disorder","180304","2020-10-21","18:00:00",""
"7151857","12.6196","0.0002","5.8517","0.0001","12.6336","0.0002","90","","99.29","0.01","90","","920.71","0.04","120","","120","","","","","","","","","3","P 1 21 1","P 2yb","4","","(1RS,2RS,3SR,13bRS)-3-Phenyl-2,3,9,13b-tetrahydro-1H- dibenzo[c,f]pyrrolo[1,2-a]azepine-1,2-dicarbonitrile","","- C25 H19 N3 -","- C25 H19 N3 -","- C50 H38 N6 -","2","1","","Khlebnikov, Alexander F.; Novikov, Mikhail S.; Golovkina, Maria V.; Petrovskii, Petr P.; Konev, Alexander S.; Yufit, Dmitry S.; Stoeckli-Evans, Helen","An efficient approach to azirino and pyrrolo-fused dibenzazepines. Conformations of substituted dibenzo[c,f]pyrrolo[1,2-a]azepines.","Organic & biomolecular chemistry","2011","9","10","3886","3895","10.1039/c1ob05081h","","","1.54188","CuKα","","0.0355","0.0331","","","0.0805","0.0822","","","","","","1.066","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151858","10.6905","0.0002","7.6706","0.0001","29.1159","0.0004","90","","90.142","0.001","90","","2387.57","0.06","100","","100","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(3aRS,3bRS,14SR,14aSR)-14-(4-Chlorophenyl)-2-phenyl-3b,8,14,14a- tetrahydro-dibenzo[c,f]pyrrolo[3',4':3,4]pyrrolo[1,2-a]azepine- 1,3(2H,3aH)-dione","","- C31 H23 Cl N2 O2 -","- C31 H23 Cl N2 O2 -","- C124 H92 Cl4 N8 O8 -","4","1","","Khlebnikov, Alexander F.; Novikov, Mikhail S.; Golovkina, Maria V.; Petrovskii, Petr P.; Konev, Alexander S.; Yufit, Dmitry S.; Stoeckli-Evans, Helen","An efficient approach to azirino and pyrrolo-fused dibenzazepines. Conformations of substituted dibenzo[c,f]pyrrolo[1,2-a]azepines.","Organic & biomolecular chemistry","2011","9","10","3886","3895","10.1039/c1ob05081h","","","1.54188","CUKα","","0.0525","0.0426","","","0.113","0.1178","","","","","","1.042","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151859","10.1977","0.0015","16.971","0.003","11.0473","0.0017","90","","113.378","0.01","90","","1754.9","0.5","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H21 N O4 -","- C20 H21 N O4 -","- C80 H84 N4 O16 -","4","1","","Sun, Fang-gang; Ye, Song","N-heterocyclic carbene-catalyzed [4 + 1] annulation of phthalaldehyde and imines.","Organic & biomolecular chemistry","2011","9","10","3632","3635","10.1039/c1ob05092c","","","1.54186","CuKα","","0.0441","0.0371","","","0.0962","0.0994","","","","","","1.071","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151860","5.9224","0.0002","11.4859","0.0004","17.6998","0.0005","90","","90","","90","","1204.01","0.07","123","","123","","","","","","","","see text","3","P 21 21 21","P 2ac 2ab","19","","","","- C13 H16 O4 -","- C13 H16 O4 -","- C52 H64 O16 -","4","1","","Macabeo, Allan Patrick G.; Kreuzer, Andreas; Reiser, Oliver","Stereoselective routes to aryl substituted γ-butyrolactones and their application towards the synthesis of highly oxidised furanocembranoids.","Organic & biomolecular chemistry","2011","9","9","3146","3150","10.1039/c1ob05113j","","x-ray","1.54184","CuKα","","0.0296","0.0292","","","0.0746","0.0749","","","","","","1.074","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151861","7.8226","0.0002","10.0497","0.0002","9.1628","0.0002","90","","102.925","0.002","90","","702.08","0.03","123","","123","","","","","","","","see text","3","P 1 21 1","P 2yb","4","","","","- C13 H20 O7 -","- C13 H20 O7 -","- C26 H40 O14 -","2","1","","Macabeo, Allan Patrick G.; Kreuzer, Andreas; Reiser, Oliver","Stereoselective routes to aryl substituted γ-butyrolactones and their application towards the synthesis of highly oxidised furanocembranoids.","Organic & biomolecular chemistry","2011","9","9","3146","3150","10.1039/c1ob05113j","","x-ray","1.54184","CuKα","","0.0289","0.0282","","","0.0739","0.0742","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151862","10.838","0.001","7.683","0.001","12.432","0.001","90","","97.66","0.01","90","","1025.95","0.18","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","rac-(2S,4S,6S)-2-methyl-2,3,4,6-tetrahydro-1H-2,6- methanobenzo(c)-(1,5)oxazocin-4-ol","rac-(2S,4S,6S)-2-methyl-2,3,4,6-tetrahydro-1H-2,6-methanobenzo[c]- [1,5]oxazocin-4-ol","","- C12 H15 N O2 -","- C12 H15 N O2 -","- C48 H60 N4 O8 -","4","1","","Bourcet, Emmanuel; Bröhmer, Manuel C; Nieger, Martin; Bräse, Stefan","Synthetic studies towards marmycins A and B: development of the vinylogous aldol-aza-Michael domino reaction.","Organic & biomolecular chemistry","2011","9","9","3136","3138","10.1039/c1ob05124e","","","0.71073","MoKα","","0.0503","0.0394","","","0.0916","0.0977","","","","","","1.036","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151863","7.5344","0.0006","22.298","0.0013","7.2117","0.0007","90","","114.172","0.007","90","","1105.35","0.16","123","2","123","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","rac-(2S,4S,6S)-2,10-dimethyl-2,3,4,6-tetrahydro-1H-2,6-methanobenzo[c]- [1,5]oxazocin-4-ol","","- C13 H17 N O2 -","- C13 H17 N O2 -","- C52 H68 N4 O8 -","4","1","","Bourcet, Emmanuel; Bröhmer, Manuel C; Nieger, Martin; Bräse, Stefan","Synthetic studies towards marmycins A and B: development of the vinylogous aldol-aza-Michael domino reaction.","Organic & biomolecular chemistry","2011","9","9","3136","3138","10.1039/c1ob05124e","","","0.71073","MoKα","","0.0438","0.0403","","","0.1004","0.1033","","","","","","1.078","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151864","8.6252","0.0003","8.6773","0.0003","43.7286","0.0016","90","","90","","90","","3272.8","0.2","150","2","150","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C14 H13 Br Fe O7 -","- C14 H13 Br Fe O7 -","- C112 H104 Br8 Fe8 O56 -","8","2","","Griffen, Julia A.; Le Coz, Amélie M; Kociok-Köhn, Gabriele; Khan, Monika Ali; Stewart, Alan J. W.; Lewis, Simon E.","Expanding the chiral pool: oxidation of meta-bromobenzoic acid by R. eutrophus B9 allows access to new reaction manifolds.","Organic & biomolecular chemistry","2011","9","10","3920","3928","10.1039/c1ob05131h","","","0.71073","MoKα","","0.0677","0.0437","","","0.0788","0.086","","","","","","1.063","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151865","27.8075","0.0004","27.8075","0.0004","6.4708","0.0001","90","","90","","120","","4333.24","0.11","150","2","150","2","","","","","","","","5","P 65","P 65","170","","","","- C19 H18 Br N3 O6 -","- C19 H18 Br N3 O6 -","- C114 H108 Br6 N18 O36 -","6","1","","Griffen, Julia A.; Le Coz, Amélie M; Kociok-Köhn, Gabriele; Khan, Monika Ali; Stewart, Alan J. W.; Lewis, Simon E.","Expanding the chiral pool: oxidation of meta-bromobenzoic acid by R. eutrophus B9 allows access to new reaction manifolds.","Organic & biomolecular chemistry","2011","9","10","3920","3928","10.1039/c1ob05131h","","","1.54184","CuKα","","0.0418","0.0379","","","0.085","0.0864","","","","","","1.086","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151866","9.1431","0.001","9.1984","0.0011","21.398","0.003","98.89","0.002","92.687","0.002","95.661","0.002","1765.8","0.4","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C15 H19 F3 N2 O3 S -","- C15 H19 F3 N2 O3 S -","- C60 H76 F12 N8 O12 S4 -","4","2","","Zhang, Fan; Liu, Zhen-Jiang; Liu, Jin-Tao","Asymmetric aza-Henry reaction of chiral fluoroalkyl α,β-unsaturated N-tert-butanesulfinyl ketoimines: an efficient approach to enantiopure fluoroalkylated α,β-diamines and α,β-diamino acids.","Organic & biomolecular chemistry","2011","9","10","3625","3628","10.1039/c1ob05132f","","","0.71073","MoKα","","0.0917","0.0562","","","0.1244","0.1391","","","","","","0.888","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151867","28.269","0.003","30.785","0.003","7.2402","0.0007","90","","90","","90","","6300.9","1.1","100","0.1","100","0.1","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C16 H18 N2 O6 -","- C16 H18 N2 O6 -","- C256 H288 N32 O96 -","16","1","","Huang, Chengmei; Yu, Haitao; Miao, Zhengrui; Zhou, Jie; Wang, Shuai; Fun, Hoong-Kun; Xu, Jianhua; Zhang, Yan","Facile synthesis of spiroisoquinolines based on photocycloaddition of isoquinoline-1,3,4-trione with oxazoles.","Organic & biomolecular chemistry","2011","9","10","3629","3631","10.1039/c1ob05143a","","","0.71073","MoKα","","0.0598","0.0472","","","0.1266","0.1362","","","","","","1.041","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151868","9.2295","0.0005","11.037","0.0007","17.1487","0.0008","90","","121.994","0.003","90","","1481.53","0.15","100","0.1","100","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C16 H16 N2 O5 -","- C16 H16 N2 O5 -","- C64 H64 N8 O20 -","4","1","","Huang, Chengmei; Yu, Haitao; Miao, Zhengrui; Zhou, Jie; Wang, Shuai; Fun, Hoong-Kun; Xu, Jianhua; Zhang, Yan","Facile synthesis of spiroisoquinolines based on photocycloaddition of isoquinoline-1,3,4-trione with oxazoles.","Organic & biomolecular chemistry","2011","9","10","3629","3631","10.1039/c1ob05143a","","","0.71073","MoKα","","0.0419","0.0363","","","0.1023","0.1077","","","","","","1.051","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151869","30.1583","0.0005","13.3236","0.0002","16.1956","0.0003","90","","107.909","0.001","90","","6192.35","0.18","100","","100","","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C16 H18 N2 O6 -","- C16 H18 N2 O6 -","- C256 H288 N32 O96 -","16","4","","Huang, Chengmei; Yu, Haitao; Miao, Zhengrui; Zhou, Jie; Wang, Shuai; Fun, Hoong-Kun; Xu, Jianhua; Zhang, Yan","Facile synthesis of spiroisoquinolines based on photocycloaddition of isoquinoline-1,3,4-trione with oxazoles.","Organic & biomolecular chemistry","2011","9","10","3629","3631","10.1039/c1ob05143a","","","0.71073","MoKα","","0.0561","0.0466","","","0.1172","0.1279","","","","","","1.048","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151870","8.39707","0.00008","9.14896","0.00009","35.0858","0.0003","90","","90","","90","","2695.45","0.04","100","2","100","2","","","","","","","","7","P 21 21 21","P 2ac 2ab","19","","","","- C31 H33 Cl N2 O2 Ru S -","- C31 H33 Cl N2 O2 Ru S -","- C124 H132 Cl4 N8 O8 Ru4 S4 -","4","1","","Soni, Rina; Cheung, Fung Kei; Clarkson, Guy C.; Martins, Jose E. D.; Graham, Mark A.; Wills, Martin","The importance of the N-H bond in Ru/TsDPEN complexes for asymmetric transfer hydrogenation of ketones and imines.","Organic & biomolecular chemistry","2011","9","9","3290","3294","10.1039/c1ob05208j","","","1.54184","CuKα","","0.0299","0.0292","","","0.0742","0.0745","","","","","","1.096","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151871","10.3603","0.0002","11.0519","0.0003","14.0747","0.0003","90.6376","0.0019","103.528","0.0017","107.614","0.002","1487.55","0.06","100","2","100","2","","","","","","","","7","P 1","P 1","1","","","","- C31 H37 Cl N2 O3 Ru S -","- C31 H37 Cl N2 O3 Ru S -","- C62 H74 Cl2 N4 O6 Ru2 S2 -","2","2","","Soni, Rina; Cheung, Fung Kei; Clarkson, Guy C.; Martins, Jose E. D.; Graham, Mark A.; Wills, Martin","The importance of the N-H bond in Ru/TsDPEN complexes for asymmetric transfer hydrogenation of ketones and imines.","Organic & biomolecular chemistry","2011","9","9","3290","3294","10.1039/c1ob05208j","","","0.71073","MoKα","","0.0247","0.0233","","","0.0548","0.0553","","","","","","1.004","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151872","21.472","0.003","7.807","0.006","25.852","0.004","90","","115.95","0.02","90","","3897","3","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","2,4-diphenyloctahydroquinolin-1(2H)-ol","2,4-diphenyloctahydroquinolin-1(2H)-ol","","- C24 H28 N O -","- C24 H28 N O -","- C192 H224 N8 O8 -","8","1","","Nagaraj, Muthupandi; Boominathan, Muthusamy; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai","Synthesis of novel N-hydroxy heterocycles via intramolecular reductive cyclization of diketoximes by NaBH3CN","Organic & Biomolecular Chemistry","2011","9","12","4642","","10.1039/c1ob05232b","","","0.71073","MoKα","","0.1042","0.0541","","","0.0979","0.1245","","","","","","1.023","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151873","19.532","0.003","5.3933","0.0007","16.414","0.002","90","","90.279","0.012","90","","1729.1","0.4","110","2","110","2","","","","","","","","5","C 1 2 1","C 2y","5","4-(4-chlorophenyl)-2-phenyl-N-hydroxy decahydroquinoline","4-(4-chlorophenyl)-2-phenyl-N-hydroxy decahydroquinoline","","- C21 H24 Cl N O -","- C21 H24 Cl N O -","- C84 H96 Cl4 N4 O4 -","4","1","","Nagaraj, Muthupandi; Boominathan, Muthusamy; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai","Synthesis of novel N-hydroxy heterocycles via intramolecular reductive cyclization of diketoximes by NaBH3CN","Organic & Biomolecular Chemistry","2011","9","12","4642","","10.1039/c1ob05232b","","","1.54178","CuKα","","0.0527","0.0411","","","0.0918","0.0953","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151874","26.535","0.003","26.535","0.003","13.671","0.002","90","","90","","120","","8336.2","1.8","293","2","293","2","","","","","","","","4","R -3 :H","-R 3","148","1-hydroxy2,4, 6-triiphenylpiperazine","1-hydroxy2,4, 6-triiphenylpiperazine","","- C22 H22 N2 O -","- C22 H22 N2 O -","- C396 H396 N36 O18 -","18","1","","Nagaraj, Muthupandi; Boominathan, Muthusamy; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai","Synthesis of novel N-hydroxy heterocycles via intramolecular reductive cyclization of diketoximes by NaBH3CN","Organic & Biomolecular Chemistry","2011","9","12","4642","","10.1039/c1ob05232b","","","0.71073","MoKα","","0.0993","0.0615","","","0.1764","0.1962","","","","","","1.128","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151875","6.2211","0.0003","14.25","0.0007","19.7004","0.001","90","","90","","90","","1746.45","0.15","110","2","110","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","14 December 2010","","","- C22 H22 N2 O -","- C22 H22 N2 O -","- C88 H88 N8 O4 -","4","1","","Nagaraj, Muthupandi; Boominathan, Muthusamy; Muthusubramanian, Shanmugam; Bhuvanesh, Nattamai","Synthesis of novel N-hydroxy heterocycles via intramolecular reductive cyclization of diketoximes by NaBH3CN","Organic & Biomolecular Chemistry","2011","9","12","4642","","10.1039/c1ob05232b","","","1.54178","CuKα","","0.0301","0.0274","","","0.0655","0.0662","","","","","","1.066","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151876","8.101","0.0016","11.081","0.002","16.926","0.003","100.23","0.03","99.2","0.03","104.73","0.03","1412.1","0.6","293","2","293","2","","","","","","","","7","P -1","-P 1","2","","","","- C31 H24 Cl F3 N2 O3 S -","- C31 H24 Cl F3 N2 O3 S -","- C62 H48 Cl2 F6 N4 O6 S2 -","2","1","","Chaitanya, T. Krishna; Nagarajan, Rajagopal","Synthesis of functionalized ellipticinium and ellipticine derivatives via electrophilic cyclization","Organic & Biomolecular Chemistry","2011","9","12","4662","","10.1039/c1ob05258f","","","0.71073","MoKα","","0.1654","0.0954","","","0.1895","0.224","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151877","8.1925","0.0003","16.7763","0.0008","21.6041","0.001","90","","90","","90","","2969.3","0.2","298","2","298","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C33 H29 F3 N2 O3 S -","- C33 H29 F3 N2 O3 S -","- C132 H116 F12 N8 O12 S4 -","4","1","","Chaitanya, T. Krishna; Nagarajan, Rajagopal","Synthesis of functionalized ellipticinium and ellipticine derivatives via electrophilic cyclization","Organic & Biomolecular Chemistry","2011","9","12","4662","","10.1039/c1ob05258f","","","0.71073","MoKα","","0.0962","0.0607","","","0.139","0.1622","","","","","","1.029","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151878","18.2414","0.0009","5.4302","0.0002","14.7271","0.0007","90","","105.429","0.002","90","","1406.21","0.11","150","2","150","2","","","","","","","synthesis as described","3","C 1 2/c 1","-C 2yc","15","","","","- C8 H7 N3 -","- C8 H7 N3 -","- C64 H56 N24 -","8","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0462","0.0397","","","0.1059","0.1121","","","","","","1.025","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151879","7.051","0.0002","20.8154","0.0006","7.2666","0.0002","90","","100.688","0.002","90","","1048.01","0.05","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C7 H4 I2 N2 S -","- C7 H4 I2 N2 S -","- C28 H16 I8 N8 S4 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0314","0.0292","","","0.0619","0.0627","","","","","","1.201","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151880","6.8316","0.0004","13.4938","0.0007","12.1649","0.0007","90","","101.594","0.002","90","","1098.53","0.11","100","2","100","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C8 H5 I2 N3 -","- C8 H5 I2 N3 -","- C32 H20 I8 N12 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0319","0.0291","","","0.0675","0.069","","","","","","1.099","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151881","7.1532","0.0003","14.745","0.0006","8.1035","0.0004","90","","91.883","0.001","90","","854.25","0.07","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H6 I N3 -","- C8 H6 I N3 -","- C32 H24 I4 N12 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0232","0.0207","","","0.0504","0.0515","","","","","","1.12","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151882","7.1322","0.0002","10.9173","0.0003","13.3983","0.0004","90","","99.759","0.001","90","","1028.15","0.05","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","","","- C8 H5 I2 N3 -","- C8 H5 I2 N3 -","- C32 H20 I8 N12 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0195","0.018","","","0.0445","0.0451","","","","","","1.138","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151883","11.8807","0.0005","7.3931","0.0003","14.398","0.0006","90","","92.696","0.002","90","","1263.25","0.09","150","2","150","2","","","","","","","synthesis as described","5","P 1 21/n 1","-P 2yn","14","","","","- C8 H3 Cl I3 N3 -","- C8 H3 Cl I3 N3 -","- C32 H12 Cl4 I12 N12 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0461","0.04","","","0.0924","0.0955","","","","","","1.083","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151884","7.3777","0.0003","19.1576","0.0009","8.7098","0.0004","90","","111.017","0.002","90","","1149.14","0.09","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H12 I N3 -","- C11 H12 I N3 -","- C44 H48 I4 N12 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0253","0.0221","","","0.0509","0.0596","","","","","","1.21","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151885","6.9744","0.0003","26.4537","0.0012","7.2619","0.0003","90","","90.717","0.002","90","","1339.71","0.1","150","2","150","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H11 I2 N3 -","- C11 H11 I2 N3 -","- C44 H44 I8 N12 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0294","0.0281","","","0.0601","0.0606","","","","","","1.288","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151886","8.3852","0.0003","10.209","0.0003","16.0643","0.0005","90","","90","","90","","1375.18","0.08","150","2","150","2","","","","","","","synthesis as described","4","P n a b","-P 2bc 2n","60","","","","- C12 H8 I2 N4 -","- C12 H8 I2 N4 -","- C48 H32 I8 N16 -","4","0.5","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0203","0.017","","","0.0359","0.037","","","","","","1.064","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151887","6.3843","0.0005","30.629","0.002","7.1492","0.0006","90","","94.735","0.003","90","","1393.22","0.18","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 N3 -","- C17 H17 N3 -","- C68 H68 N12 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.077","0.0683","","","0.1439","0.1473","","","","","","1.188","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151888","11.299","0.003","4.2309","0.0009","14.743","0.003","90","","90.229","0.008","90","","704.8","0.3","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/a 1","-P 2yab","14","","","","- C8 H7 N3 -","- C8 H7 N3 -","- C32 H28 N12 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.0797","0.0565","","","0.1401","0.1539","","","","","","1.136","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151889","7.745","0.004","12.472","0.006","10.787","0.005","90","","92.06","0.014","90","","1041.3","0.9","150","2","150","2","","","","","","","synthesis as described","3","P 1 21/c 1","-P 2ybc","14","","","","- C12 H10 N4 -","- C12 H10 N4 -","- C48 H40 N16 -","4","1","","Chevallier, Floris; Halauko, Yury S.; Pecceu, Christelle; Nassar, Ibrahim F.; Dam, To Uyen; Roisnel, Thierry; Matulis, Vadim E.; Ivashkevich, Oleg A.; Mongin, Florence","N-aryl pyrazoles: DFT calculations of CH acidity and deprotonative metallation using a combination of lithium and zinc amides","Organic & Biomolecular Chemistry","2011","9","12","4671","","10.1039/c1ob05267e","","x-ray","0.71073","MoKα","","0.1551","0.0685","","","0.1467","0.1724","","","","","","0.927","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151890","21.913","0.003","23.156","0.003","23.85","0.004","93.385","0.006","108.751","0.006","95.706","0.005","11349","3","133","","133","","","","","","","","","6","P -1","-P 1","2","","","","- C205 H292 N16 O P12 Pt6 -","- C205 H292 N16 O P12 Pt6 -","- C410 H584 N32 O2 P24 Pt12 -","2","1","","Harano, Aya; Tanaka, Minako; Nakagaki, Takeshi; Annaka, Masahiko; Ideta, Keiko; Goto, Kenta; Shinmyozu, Teruo","Changing the volume of a giant macrocycle: the swelling of the macrocycle with organic solvents.","Organic & biomolecular chemistry","2011","9","10","3611","3614","10.1039/c1ob05272a","","","0.71075","MoKα","","","0.0888","","","","0.2755","","","","","","1.031","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151891","13.323","0.002","15.987","0.003","17.448","0.003","90","","90","","90","","3716.3","1.1","293","2","293","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C40 H36 Br N O7 -","- C40 H36 Br N O7 -","- C160 H144 Br4 N4 O28 -","4","1","","Xue, Zhi-Yong; Fang, Xin; Wang, Chun-Jiang","Asymmetric construction of 3-vinylidene-pyrrolidine derivatives containing allene moiety via Ag(I)/TF-BiphamPhos-catalyzed 1,3-dipolar cycloaddition of azomethine ylides with diethyl 2-(3,3-diphenylpropa-1,2-dienylidene) malonate.","Organic & biomolecular chemistry","2011","9","10","3622","3624","10.1039/c1ob05291h","","","0.71073","MoKα","","0.0684","0.0509","","","0.1344","0.1463","","","","","","1.019","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151892","15.475","0.006","12.2","0.004","18.441","0.007","90","","107.63","0.007","90","","3318","2","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C39 H38 N4 O5 -","- C39 H38 N4 O5 -","- C156 H152 N16 O20 -","4","1","","Liu, Wei-Yong; Li, Hai-Ying; Zhao, Bao-Xiang; Miao, Jun-Ying","Synthesis, crystal structure and living cell imaging of a Cu2±specific molecular probe","Organic & Biomolecular Chemistry","2011","9","13","4802","","10.1039/c1ob05358b","","","0.71073","MoKα","","0.0949","0.0553","","","0.1414","0.1666","","","","","","1.026","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151893","10.3869","0.0006","13.1736","0.0007","15.8519","0.0008","90","","90","","90","","2169.1","0.2","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H31 Br O3 -","- C25 H31 Br O3 -","- C100 H124 Br4 O12 -","4","1","","Stastna, Eva; Rath, Nigam P.; Covey, Douglas F.","The use of symmetry in enantioselective synthesis: Four pairs of chrysene enantiomers prepared from 19-nortestosterone","Organic & Biomolecular Chemistry","2011","9","12","4685","","10.1039/c1ob05385j","","","0.71073","MoKα","","0.0236","0.0205","","","0.0488","0.05","","","","","","1.042","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151894","7.9684","0.001","10.9755","0.0014","12.0108","0.0015","72.528","0.002","72.231","0.002","83.35","0.002","953.8","0.2","100","2","100","2","","","","","","","","4","P 1","P 1","1","","","","- C22 H17 Br O6 -","- C22 H17 Br O6 -","- C44 H34 Br2 O12 -","2","2","","Gao, Yaojun; Ren, Qiao; Ang, Swee-Meng; Wang, Jian","Enantioselective organocatalytic Michael-hemiketalization catalyzed by a trans-bifunctional indane thiourea catalyst.","Organic & biomolecular chemistry","2011","9","10","3691","3697","10.1039/c1ob05404j","","","0.71073","MoKα","","0.033","0.0302","","","0.0683","0.0698","","","","","","0.857","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151895","6.246","0.002","10.219","0.003","12.572","0.005","110.08","0.03","93.86","0.03","95.48","0.03","745.9","0.5","298","2","298","2","","","","","","","","3","P -1","-P 1","2","","","","- C17 H20 O4 -","- C17 H20 O4 -","- C34 H40 O8 -","2","1","","Merritt, Andrew T.; Pouwer, Rebecca H.; Williams, David J.; Williams, Craig M.; Ley, Steven V.","The clerodane ring system: investigating the viability of a direct Diels‒Alder approach","Organic & Biomolecular Chemistry","2011","9","13","4745","","10.1039/c1ob05422h","","","1.54178","CuKα","","0.0763","0.054","","","0.1286","0.137","","","","","","0.972","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151896","11.914","0.004","11.74","0.004","12.726","0.004","90","","106.442","0.005","90","","1707.2","1","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H25 N O Si -","- C16 H25 N O Si -","- C64 H100 N4 O4 Si4 -","4","1","","Chin, Chih-Lung; Liao, Cheng-Feng; Liu, Hsing-Jang; Wong, Ying-Chieh; Hsieh, Ming-Tsang; Amancha, Prashanth K.; Chang, Chun-Ping; Shia, Kak-Shan","Conia-ene annulation of the α-cyano β-TMS-capped alkynyl cycloalkanone system and its synthetic application","Organic & Biomolecular Chemistry","2011","9","13","4778","","10.1039/c1ob05591g","","","0.71073","MoKα","","0.1534","0.0567","","","0.1344","0.1603","","","","","","0.802","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151897","10.5629","0.0009","12.6906","0.001","12.5122","0.0009","90","","100.65","0.005","90","","1648.4","0.2","100","0.1","100","0.1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H27 N O Si -","- C16 H27 N O Si -","- C64 H108 N4 O4 Si4 -","4","1","","Chin, Chih-Lung; Liao, Cheng-Feng; Liu, Hsing-Jang; Wong, Ying-Chieh; Hsieh, Ming-Tsang; Amancha, Prashanth K.; Chang, Chun-Ping; Shia, Kak-Shan","Conia-ene annulation of the α-cyano β-TMS-capped alkynyl cycloalkanone system and its synthetic application","Organic & Biomolecular Chemistry","2011","9","13","4778","","10.1039/c1ob05591g","","","0.71073","MoKα","","0.0836","0.0366","","","0.0618","0.0668","","","","","","0.758","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151898","17.6183","0.0011","6.826","0.0004","25.7319","0.0016","90","","109.769","0.001","90","","2912.2","0.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C14 H21 N O Si -","- C14 H21 N O Si -","- C112 H168 N8 O8 Si8 -","8","2","","Chin, Chih-Lung; Liao, Cheng-Feng; Liu, Hsing-Jang; Wong, Ying-Chieh; Hsieh, Ming-Tsang; Amancha, Prashanth K.; Chang, Chun-Ping; Shia, Kak-Shan","Conia-ene annulation of the α-cyano β-TMS-capped alkynyl cycloalkanone system and its synthetic application","Organic & Biomolecular Chemistry","2011","9","13","4778","","10.1039/c1ob05591g","","","0.71073","MoKα","","0.1407","0.052","","","0.1137","0.1464","","","","","","0.9","","","","has coordinates","180304","2020-10-21","18:00:00",""
"7151899","6.526","0.006","11.83","0.01","12.312","0.011","90","","104.267","0.013","90","","921.2","1.4","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H28 O7 -","- C20 H28 O7 -","- C40 H56 O14 -","2","1","","Zhang, Mei; Zhang, Yangming; Lu, Wei; Nan, Fa-Jun","Synthesis and revision of stereochemistry of rubescensin S","Organic & Biomolecular Chemistry","2011","9","12","4436","","10.1039/c1ob05611e","","","0.71073","MoKα","","0.1322","0.086","","","0.149","0.1641","","","","","","1.164","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151900","26.995","0.005","6.0828","0.0012","14.322","0.003","90","","117.723","0.003","90","","2081.8","0.7","293","2","293","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C22 H32 O8 -","- C22 H32 O8 -","- C88 H128 O32 -","4","1","","Zhang, Mei; Zhang, Yangming; Lu, Wei; Nan, Fa-Jun","Synthesis and revision of stereochemistry of rubescensin S","Organic & Biomolecular Chemistry","2011","9","12","4436","","10.1039/c1ob05611e","","","0.71073","MoKα","","0.067","0.061","","","0.1594","0.1647","","","","","","0.999","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151901","9.6172","0.0017","14.543","0.003","27.025","0.005","90","","90","","90","","3779.8","1.2","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19.5 H28 O8.5 -","- C19.5 H28 O8.5 -","- C156 H224 O68 -","8","2","","Zhang, Mei; Zhang, Yangming; Lu, Wei; Nan, Fa-Jun","Synthesis and revision of stereochemistry of rubescensin S","Organic & Biomolecular Chemistry","2011","9","12","4436","","10.1039/c1ob05611e","","","0.71073","MoKα","","0.0933","0.0628","","","0.166","0.1948","","","","","","1.209","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151902","10.3751","0.001","7.7786","0.0007","11.4085","0.0011","90","","99.955","0.002","90","","906.85","0.15","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H28 O7 -","- C20 H28 O7 -","- C40 H56 O14 -","2","1","","Zhang, Mei; Zhang, Yangming; Lu, Wei; Nan, Fa-Jun","Synthesis and revision of stereochemistry of rubescensin S","Organic & Biomolecular Chemistry","2011","9","12","4436","","10.1039/c1ob05611e","","","0.71073","MoKα","","0.0375","0.0365","","","0.0918","0.0927","","","","","","1.067","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151903","4.942","0.004","11.622","0.011","15.783","0.014","90","","93.573","0.014","90","","904.7","1.4","296","2","296","2","","","101.325","","","","synthesis","4","P 1 21 1","P 2yb","4","Fmoc-Val-CH2OH","Fmoc-Val-CH2OH","","- C20 H23 N O3 -","- C20 H23 N O3 -","- C40 H46 N2 O6 -","2","1","","Jadhav, Sandip V.; Bandyopadhyay, Anupam; Benke, Sushil N.; Mali, Sachitanand M.; Gopi, Hosahudya N.","A facile synthesis and crystallographic analysis of N-protected β-amino alcohols and short peptaibols.","Organic & biomolecular chemistry","2011","9","11","4182","4187","10.1039/c0ob01226b","","x-ray","0.71073","MoKα","","0.0758","0.041","","","0.0508","0.0548","","","","","","1.456","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151904","10.578","0.004","11.206","0.004","23.306","0.008","90","","90","","90","","2762.6","1.7","296","2","296","2","","","101.325","","","","synthesis","5","P 21 21 21","P 2ac 2ab","19","Boc-Aib-Ala-Leu-CH2OH","Boc-Aib-Ala-Leu-CH2OH","","- C19 H36 Cl3 N3 O5 -","- C19 H36 Cl3 N3 O5 -","- C76 H144 Cl12 N12 O20 -","4","1","","Jadhav, Sandip V.; Bandyopadhyay, Anupam; Benke, Sushil N.; Mali, Sachitanand M.; Gopi, Hosahudya N.","A facile synthesis and crystallographic analysis of N-protected β-amino alcohols and short peptaibols.","Organic & biomolecular chemistry","2011","9","11","4182","4187","10.1039/c0ob01226b","","x-ray","0.71073","MoKα","","0.2755","0.0673","","","0.1608","0.2113","","","","","","0.715","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151905","9.704","0.003","13.077","0.003","25.661","0.007","90","","90","","90","","3256.4","1.5","296","2","200","","","","101.325","","","","Synthesis","4","P 21 21 21","P 2ac 2ab","19","Dipeptide alcohol","Dipeptide alcohol","","- C13 H26 N2 O4 -","- C13 H26 N2 O4 -","- C104 H208 N16 O32 -","8","2","","Jadhav, Sandip V.; Bandyopadhyay, Anupam; Benke, Sushil N.; Mali, Sachitanand M.; Gopi, Hosahudya N.","A facile synthesis and crystallographic analysis of N-protected β-amino alcohols and short peptaibols.","Organic & biomolecular chemistry","2011","9","11","4182","4187","10.1039/c0ob01226b","","x-ray","0.71073","MoKα","","0.1186","0.0653","","","0.0964","0.1069","","","","","","1.592","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151906","6.967","0.0014","10.517","0.002","11.826","0.002","87.388","0.003","73.485","0.003","85.092","0.003","827.5","0.3","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C16 H20 N2 O4 Se -","- C16 H20 N2 O4 Se -","- C32 H40 N4 O8 Se2 -","2","1","","Bhabak, Krishna P.; Vernekar, Amit A.; Jakka, Surendar R.; Roy, Gouriprasanna; Mugesh, Govindasamy","Mechanistic investigations on the efficient catalytic decomposition of peroxynitrite by ebselen analogues.","Organic & biomolecular chemistry","2011","9","14","5193","5200","10.1039/c0ob01234c","","","0.71073","MoKα","","0.0451","0.0395","","","0.1084","0.1116","","","","","","1.078","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151907","9.0838","0.0014","24.279","0.002","14.5751","0.0018","90","","102.451","0.002","90","","3138.9","0.7","298","2","298","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C16 H19 N5 -","- C16 H19 N5 -","- C128 H152 N40 -","8","1","","Jiang, Bo; Wang, Xiang; Shi, Feng; Tu, Shu-Jiang; Li, Guigen","New multicomponent cyclization: domino synthesis of pentasubstituted pyridines under solvent-free conditions.","Organic & biomolecular chemistry","2011","9","11","4025","4028","10.1039/c0ob01258k","","","0.71073","MoKα","","0.143","0.0721","","","0.1719","0.1987","","","","","","1.052","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151908","12.6769","0.0002","12.8446","0.0002","14.6153","0.0003","91.343","0.001","94.061","0.001","106.217","0.001","2277.06","0.07","93","2","93","2","","","","","","","","3","P -1","-P 1","2","","","","- C50 H66 O6 -","- C50 H66 O6 -","- C100 H132 O12 -","2","1","","Fischer, Conrad; Gruber, Tobias; Seichter, Wilhelm; Weber, Edwin","Bridge-substituted calix[4]arenes: syntheses, conformations and application.","Organic & biomolecular chemistry","2011","9","11","4347","4352","10.1039/c1ob00028d","","","0.71073","MoKα","","0.0525","0.0395","","","0.1108","0.1304","","","","","","1.081","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151909","11.5457","0.0002","24.1928","0.0005","17.0958","0.0003","90","","96.098","0.001","90","","4748.23","0.15","133","2","133","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C52 H70 O6 -","- C52 H70 O6 -","- C208 H280 O24 -","4","1","","Fischer, Conrad; Gruber, Tobias; Seichter, Wilhelm; Weber, Edwin","Bridge-substituted calix[4]arenes: syntheses, conformations and application.","Organic & biomolecular chemistry","2011","9","11","4347","4352","10.1039/c1ob00028d","","","0.71073","MoKα","","0.0943","0.0581","","","0.152","0.1674","","","","","","0.941","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151910","7.168","0.003","15.046","0.007","9.688","0.004","90","","90","","90","","1044.8","0.8","296","2","296","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C14 H11 N O2 -","- C14 H11 N O2 -","- C56 H44 N4 O8 -","4","1","","Wang, Ren; Lu, Shen-Ci; Zhang, Yi-Ming; Shi, Zong-Jun; Zhang, Wei","One-pot synthesis of benzo[f]quinolin-3-ones and benzo[a]phenanthridein-5-ones by the photoanuulation of 6-chloropyridin-2-ones and 3-chloroisoquinolin-1-ones to phenylacetylene.","Organic & biomolecular chemistry","2011","9","16","5802","5808","10.1039/c1ob05082f","","","0.71073","MoKα","","0.0612","0.0429","","","0.0879","0.0966","","","","","","0.975","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151911","7.272","0.004","11.909","0.006","17.041","0.008","90","","90","","90","","1475.8","1.3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C20 H14 Cl N O -","- C20 H14 Cl N O -","- C80 H56 Cl4 N4 O4 -","4","1","","Wang, Ren; Lu, Shen-Ci; Zhang, Yi-Ming; Shi, Zong-Jun; Zhang, Wei","One-pot synthesis of benzo[f]quinolin-3-ones and benzo[a]phenanthridein-5-ones by the photoanuulation of 6-chloropyridin-2-ones and 3-chloroisoquinolin-1-ones to phenylacetylene.","Organic & biomolecular chemistry","2011","9","16","5802","5808","10.1039/c1ob05082f","","","0.71073","MoKα","","0.1164","0.0616","","","0.1496","0.1772","","","","","","0.974","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151912","10.628","0.004","34.498","0.009","7.374","0.003","90","","90","","90","","2703.6","1.7","93","2","93","2","","","","","","","","6","I b a 2","I 2 -2c","45","","","","- C12 H14 B F4 N3 O -","- C12 H14 B F4 N3 O -","- C96 H112 B8 F32 N24 O8 -","8","1","","Campbell, Craig D.; Collett, Christopher J.; Thomson, Jennifer E.; Slawin, Alexandra M. Z.; Smith, Andrew D.","Organic base effects in NHC promoted O- to C-carboxyl transfer; chemoselectivity profiles, mechanistic studies and domino catalysis.","Organic & biomolecular chemistry","2011","9","11","4205","4218","10.1039/c1ob05160a","","","0.71073","MoKα","","0.1024","0.0586","","","0.0972","0.1106","","","","","","1.041","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151913","6.7538","0.0009","10.5562","0.0015","17.047","0.002","90","","90","","90","","1215.4","0.3","93","2","93","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C11 H12 B F4 N3 -","- C11 H12 B F4 N3 -","- C44 H48 B4 F16 N12 -","4","1","","Campbell, Craig D.; Collett, Christopher J.; Thomson, Jennifer E.; Slawin, Alexandra M. Z.; Smith, Andrew D.","Organic base effects in NHC promoted O- to C-carboxyl transfer; chemoselectivity profiles, mechanistic studies and domino catalysis.","Organic & biomolecular chemistry","2011","9","11","4205","4218","10.1039/c1ob05160a","","","0.71073","MoKα","","0.0459","0.0439","","","0.1195","0.1218","","","","","","1.068","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151914","8.2061","0.0017","7.6948","0.0016","10.792","0.002","90","","101.725","0.005","90","","667.2","0.2","93","2","93","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C11 H7 B F9 N3 -","- C11 H7 B F9 N3 -","- C22 H14 B2 F18 N6 -","2","1","","Campbell, Craig D.; Collett, Christopher J.; Thomson, Jennifer E.; Slawin, Alexandra M. Z.; Smith, Andrew D.","Organic base effects in NHC promoted O- to C-carboxyl transfer; chemoselectivity profiles, mechanistic studies and domino catalysis.","Organic & biomolecular chemistry","2011","9","11","4205","4218","10.1039/c1ob05160a","","","0.71073","MoKα","","0.0638","0.0528","","","0.1303","0.1421","","","","","","1.051","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151915","5.5353","0.0002","6.5391","0.0003","15.0596","0.0007","85.657","0.001","81.972","0.001","89.189","0.002","538.2","0.04","150","2","150","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C11 H10 Cl N3 O -","- C11 H10 Cl N3 O -","- C22 H20 Cl2 N6 O2 -","2","1","","Zeghada, Sarah; Bentabed-Ababsa, Ghenia; Derdour, Aïcha; Abdelmounim, Safer; Domingo, Luis R.; Sáez, José A; Roisnel, Thierry; Nassar, Ekhlass; Mongin, Florence","A combined experimental and theoretical study of the thermal cycloaddition of aryl azides with activated alkenes.","Organic & biomolecular chemistry","2011","9","11","4295","4305","10.1039/c1ob05176h","","x-ray","0.71073","MoKα","","0.0317","0.0302","","","0.0817","0.0834","","","","","","1.038","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151916","5.6105","0.0002","6.4884","0.0003","15.2886","0.0007","86.338","0.002","81.785","0.002","89.249","0.002","549.71","0.04","100","2","100","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C11 H10 Br N3 O -","- C11 H10 Br N3 O -","- C22 H20 Br2 N6 O2 -","2","1","","Zeghada, Sarah; Bentabed-Ababsa, Ghenia; Derdour, Aïcha; Abdelmounim, Safer; Domingo, Luis R.; Sáez, José A; Roisnel, Thierry; Nassar, Ekhlass; Mongin, Florence","A combined experimental and theoretical study of the thermal cycloaddition of aryl azides with activated alkenes.","Organic & biomolecular chemistry","2011","9","11","4295","4305","10.1039/c1ob05176h","","x-ray","0.71073","MoKα","","0.0192","0.0179","","","0.0446","0.0452","","","","","","1.054","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151917","3.8164","0.0001","12.722","0.0003","46.6476","0.0013","90","","90","","90","","2264.85","0.1","150","2","150","2","","","","","","","synthesis as described","5","P b c 21","P 2c -2b","29","","","","- C11 H10 Cl N3 O2 -","- C11 H10 Cl N3 O2 -","- C88 H80 Cl8 N24 O16 -","8","2","","Zeghada, Sarah; Bentabed-Ababsa, Ghenia; Derdour, Aïcha; Abdelmounim, Safer; Domingo, Luis R.; Sáez, José A; Roisnel, Thierry; Nassar, Ekhlass; Mongin, Florence","A combined experimental and theoretical study of the thermal cycloaddition of aryl azides with activated alkenes.","Organic & biomolecular chemistry","2011","9","11","4295","4305","10.1039/c1ob05176h","","x-ray","0.71073","MoKα","","0.0454","0.0403","","","0.0874","0.0898","","","","","","1.08","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151918","28.52","0.005","8.754","0.005","14.701","0.005","90","0.005","110.802","0.005","90","0.005","3431","2","100","2","100","2","","","","","","","synthesis as described","4","C 1 2/c 1","-C 2yc","15","","","","- C21 H14 N4 O3 -","- C21 H14 N4 O3 -","- C168 H112 N32 O24 -","8","1","","Zeghada, Sarah; Bentabed-Ababsa, Ghenia; Derdour, Aïcha; Abdelmounim, Safer; Domingo, Luis R.; Sáez, José A; Roisnel, Thierry; Nassar, Ekhlass; Mongin, Florence","A combined experimental and theoretical study of the thermal cycloaddition of aryl azides with activated alkenes.","Organic & biomolecular chemistry","2011","9","11","4295","4305","10.1039/c1ob05176h","","x-ray","0.71073","MoKα","","0.0446","0.037","","","0.0905","0.0953","","","","","","1.056","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151919","14.338","0.001","34.567","0.003","18.529","0.002","90","","106.02","0.01","90","","8826.7","1.4","110","","110","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C96 H124 O10 P4 S2 -","- C96 H124 O10 P4 S2 -","- C384 H496 O40 P16 S8 -","4","1","","Vachon, Jérôme; Harthong, Steven; Jeanneau, Erwann; Aronica, Christophe; Vanthuyne, Nicolas; Roussel, Christian; Dutasta, Jean-Pierre","Inherently chiral phosphonatocavitands as artificial chemo- and enantio-selective receptors of natural ammoniums.","Organic & biomolecular chemistry","2011","9","14","5086","5091","10.1039/c1ob05194f","","","1.5418","CuKα","","0.1591","0.1298","","0.295","0.2574","0.295","","","","","","1.072","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151920","11.9557","0.0004","15.3805","0.0004","22.8398","0.0006","95.81","0.002","95.876","0.002","90.902","0.002","4154.9","0.2","100","","100","","","","","","","","","5","P -1","-P 1","2","","","","- C87 H123 Cl3 O11 P2 -","- C87 H123 Cl3 O11 P2 -","- C174 H246 Cl6 O22 P4 -","2","1","","Vachon, Jérôme; Harthong, Steven; Jeanneau, Erwann; Aronica, Christophe; Vanthuyne, Nicolas; Roussel, Christian; Dutasta, Jean-Pierre","Inherently chiral phosphonatocavitands as artificial chemo- and enantio-selective receptors of natural ammoniums.","Organic & biomolecular chemistry","2011","9","14","5086","5091","10.1039/c1ob05194f","","","1.5418","CuKα","","0.0993","0.0923","","0.1992","0.19","0.1992","","","","","","1.0423","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151921","9.713","0.002","11.179","0.002","13.663","0.003","90","","109.59","0.03","90","","1397.7","0.6","293","2","293","2","","","","","","","synthesis as described","4","P 1 21/n 1","-P 2yn","14","Compound 7","5-hydroxy-2-(p-tolylthio)naphthalene-1,4-dione","","- C17 H12 O3 S -","- C17 H12 O3 S -","- C68 H48 O12 S4 -","4","1","","da Rocha, David R.; de Souza, Ana C. G.; Resende, Jackson A. L. C.; Santos, Wilson C.; dos Santos, Evelyne A.; Pessoa, Cláudia; de Moraes, Manoel O.; Costa-Lotufo, Letícia V; Montenegro, Raquel C.; Ferreira, Vitor F.","Synthesis of new 9-hydroxy-α- and 7-hydroxy-β-pyran naphthoquinones and cytotoxicity against cancer cell lines.","Organic & biomolecular chemistry","2011","9","11","4315","4322","10.1039/c1ob05209h","","x-ray","0.71073","MoKα","","0.1224","0.0509","","","0.1104","0.1351","","","","","","0.951","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151922","8.9234","0.0007","8.6499","0.0007","17.8425","0.0008","90","","103.821","0.007","90","","1337.33","0.17","130","2","130","2","","","","","","","synthesis as described","4","P 1 21/c 1","-P 2ybc","14","","8-hydroxy-2-(p-tolylthio)naphthalene-1,4-dione","","- C17 H12 O3 S -","- C17 H12 O3 S -","- C68 H48 O12 S4 -","4","1","","da Rocha, David R.; de Souza, Ana C. G.; Resende, Jackson A. L. C.; Santos, Wilson C.; dos Santos, Evelyne A.; Pessoa, Cláudia; de Moraes, Manoel O.; Costa-Lotufo, Letícia V; Montenegro, Raquel C.; Ferreira, Vitor F.","Synthesis of new 9-hydroxy-α- and 7-hydroxy-β-pyran naphthoquinones and cytotoxicity against cancer cell lines.","Organic & biomolecular chemistry","2011","9","11","4315","4322","10.1039/c1ob05209h","","x-ray","1.54184","CuKα","","0.0476","0.0345","","","0.0869","0.0934","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151923","10.879","0.007","8.725","0.006","17.898","0.012","90","","92.108","0.009","90","","1698","2","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H19 N O2 S -","- C18 H19 N O2 S -","- C72 H76 N4 O8 S4 -","4","1","","Zhou, Wei; An, Guanghui; Zhang, Guangqian; Han, Jianlin; Pan, Yi","Ligand-free palladium-catalyzed intramolecular Heck reaction of secondary benzylic bromides.","Organic & biomolecular chemistry","2011","9","16","5833","5837","10.1039/c1ob05231d","","","0.71073","MoKα","","0.0985","0.065","","","0.1438","0.1506","","","","","","1.049","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151924","18.6624","0.0003","6.6549","0.0001","19.1657","0.0004","90","","105.704","0.0008","90","","2291.46","0.07","90","","90","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20.5 H26.5 N4 O11.75 Os -","- C20.5 H23.5 N4 O11.75 Os -","- C82 H94 N16 O47 Os4 -","4","2","","Sugizaki, Kaori; Ikeda, Shuji; Yanagisawa, Hiroyuki; Okamoto, Akimitsu","Facile synthesis of hydroxymethylcytosine-containing oligonucleotides and their reactivity upon osmium oxidation.","Organic & biomolecular chemistry","2011","9","11","4176","4181","10.1039/c1ob05247k","","","0.71073","MoKα","","0.0395","0.033","","","0.0688","0.0712","","","","","","1.02","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7151925","11.4682","0.0011","19.7219","0.0018","9.6293","0.0009","90","","103.607","0.005","90","","2116.8","0.3","296","2","296","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","Triazolo-pyrazine","","","- C23 H25 F N4 O2 S -","- C23 H25 F N4 O2 S -","- C92 H100 F4 N16 O8 S4 -","4","1","","Chowdhury, Chinmay; Mukherjee, Sanjukta; Chakraborty, Biswajit; Achari, Basudeb","A rapid and facile method for the general synthesis of 3-aryl substituted 4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazines and their ring fused analogues.","Organic & biomolecular chemistry","2011","9","16","5856","5862","10.1039/c1ob05255a","","","0.71073","MoKα","","0.0511","0.0423","","","0.1308","0.1436","","","","","","1.012","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151926","7.9258","0.0004","16.4316","0.0008","12.9933","0.0006","90","","105.595","0.002","90","","1629.87","0.14","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","Triazolo-pyrazine","","","- C18 H15 F3 N4 -","- C18 H15 F3 N4 -","- C72 H60 F12 N16 -","4","2","","Chowdhury, Chinmay; Mukherjee, Sanjukta; Chakraborty, Biswajit; Achari, Basudeb","A rapid and facile method for the general synthesis of 3-aryl substituted 4,5,6,7-tetrahydro[1,2,3]triazolo[1,5-a]pyrazines and their ring fused analogues.","Organic & biomolecular chemistry","2011","9","16","5856","5862","10.1039/c1ob05255a","","","0.71073","MoKα","","0.1039","0.0783","","","0.2102","0.2271","","","","","","1.109","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151927","4.8025","0.0002","11.5872","0.0008","33.05","0.002","90","","90","","90","","1839.15","0.19","120","2","120","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","N-(7-Methoxy-5H-pyrrolo[1,2-a]quinoxalin-4-ylidene)-N'-quinolin- 4-ylmethylene-hydrazine hydrate","","- C22 H19 N5 O2 -","- C22 H19 N5 O2 -","- C88 H76 N20 O8 -","4","1","","Gemma, Sandra; Colombo, Laura; Forloni, Gianluigi; Savini, Luisa; Fracasso, Claudia; Caccia, Silvio; Salmona, Mario; Brindisi, Margherita; Joshi, Bhupendra P.; Tripaldi, Pierangela; Giorgi, Gianluca; Taglialatela-Scafati, Orazio; Novellino, Ettore; Fiorini, Isabella; Campiani, Giuseppe; Butini, Stefania","Pyrroloquinoxaline hydrazones as fluorescent probes for amyloid fibrils.","Organic & biomolecular chemistry","2011","9","14","5137","5148","10.1039/c1ob05288h","","","0.71073","MoKα","","0.1048","0.0573","","","0.0966","0.1106","","","","","","1.028","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151928","24.252","0.003","9.3398","0.0011","17.6282","0.0017","90","","102.784","0.005","90","","3894","0.8","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","N-(7-Methoxy-5H-pyrrolo[1,2-a]quinoxalin-4-ylidene)-N'-quinolin-4-ylmethylene- -hydrazine hydrate with methanol","","- C22.42 H17 N5 O2 -","- C22.416 H17 N5 O2 -","- C179.328 H136 N40 O16 -","8","1","","Gemma, Sandra; Colombo, Laura; Forloni, Gianluigi; Savini, Luisa; Fracasso, Claudia; Caccia, Silvio; Salmona, Mario; Brindisi, Margherita; Joshi, Bhupendra P.; Tripaldi, Pierangela; Giorgi, Gianluca; Taglialatela-Scafati, Orazio; Novellino, Ettore; Fiorini, Isabella; Campiani, Giuseppe; Butini, Stefania","Pyrroloquinoxaline hydrazones as fluorescent probes for amyloid fibrils.","Organic & biomolecular chemistry","2011","9","14","5137","5148","10.1039/c1ob05288h","","","0.71073","MoKα","","0.1469","0.0932","","","0.218","0.244","","","","","","1.09","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151929","6.352","0.003","7.033","0.003","10.437","0.004","83.301","0.007","77.06","0.007","77.613","0.007","442.7","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C11 H10 O2 -","- C11 H10 O2 -","- C22 H20 O4 -","2","1","","Nair, Vijay; Sinu, C. R.; Rejithamol, R.; Seetha Lakshmi, K. C.; Suresh, Eringathodi","A novel NHC-catalyzed transformation of 2H-chromene-3-carboxaldehydes to 3-methyl-2H-chromen-2-ones.","Organic & biomolecular chemistry","2011","9","15","5511","5514","10.1039/c1ob05325f","","","0.71073","MoKα","","0.0663","0.0602","","","0.1584","0.1636","","","","","","1.061","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151930","7.3206","0.001","19.054","0.003","8.7032","0.0012","90","","99.593","0.002","90","","1197","0.3","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C11 H5 Cl3 N4 -","- C11 H5 Cl3 N4 -","- C44 H20 Cl12 N16 -","4","1","","Niu, Hong-Ying; Xia, Chao; Qu, Gui-Rong; Zhang, Qian; Jiang, Yi; Mao, Run-Ze; Li, De-Yang; Guo, Hai-Ming","CuBr Catalyzed C-N cross coupling reaction of purines and diaryliodonium salts to 9-arylpurines.","Organic & biomolecular chemistry","2011","9","14","5039","5042","10.1039/c1ob05333g","","","0.71073","MoKα","","0.0526","0.0458","","","0.1353","0.1412","","","","","","1.082","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151931","7.4524","0.001","19.81","0.003","11.805","0.0016","90","","90.816","0.003","90","","1742.6","0.4","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C23 H17 F N2 -","- C23 H17 F N2 -","- C92 H68 F4 N8 -","4","1","","Chen, Zixian; Zhu, Jiangtao; Xie, Haibo; Li, Shan; Wu, Yongming; Gong, Yuefa","Selective synthesis of poly-substituted fluorine-containing pyridines and dihydropyrimidines via cascade C-F bond cleavage protocol.","Organic & biomolecular chemistry","2011","9","16","5682","5691","10.1039/c1ob05371j","","","0.71073","MoKα","","0.1051","0.0472","","","0.088","0.1012","","","","","","0.802","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151932","23.699","0.002","10.1868","0.0009","17.9095","0.0017","90","","123.02","0.001","90","","3625.3","0.6","293","2","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C23 H18 F2 N2 -","- C23 H18 F2 N2 -","- C184 H144 F16 N16 -","8","1","","Chen, Zixian; Zhu, Jiangtao; Xie, Haibo; Li, Shan; Wu, Yongming; Gong, Yuefa","Selective synthesis of poly-substituted fluorine-containing pyridines and dihydropyrimidines via cascade C-F bond cleavage protocol.","Organic & biomolecular chemistry","2011","9","16","5682","5691","10.1039/c1ob05371j","","","0.71073","MoKα","","0.0683","0.0559","","","0.1447","0.1527","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151933","19.404","0.004","8.0536","0.0016","11.589","0.002","90","","102.32","0.03","90","","1769.3","0.6","293","2","293","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C21 H19 N O4 -","- C21 H19 N O4 -","- C84 H76 N4 O16 -","4","1","","Jiang, Huanfeng; Ji, Xiaochen; Li, Yibiao; Chen, Zhengwang; Wang, Azhong","Palladium-assisted multicomponent cyclization of aromatic aldehydes, arylamines and terminal olefins under molecular oxygen: an assembly of 1,4-dihydropyridines.","Organic & biomolecular chemistry","2011","9","15","5358","5361","10.1039/c1ob05440f","","","0.71073","MoKα","","0.1056","0.0401","","","0.0815","0.1257","","","","","","1.132","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151934","13.657","0.003","8.1149","0.0016","13.751","0.003","90","","94.69","0.03","90","","1518.9","0.6","293","2","293","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C19 H13 N3 -","- C19 H13 N3 -","- C76 H52 N12 -","4","1","","Jiang, Huanfeng; Ji, Xiaochen; Li, Yibiao; Chen, Zhengwang; Wang, Azhong","Palladium-assisted multicomponent cyclization of aromatic aldehydes, arylamines and terminal olefins under molecular oxygen: an assembly of 1,4-dihydropyridines.","Organic & biomolecular chemistry","2011","9","15","5358","5361","10.1039/c1ob05440f","","","0.71073","MoKα","","0.0633","0.0429","","","0.1039","0.1265","","","","","","1.047","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151935","5.935","0.003","23.843","0.01","11.898","0.005","90","","93.864","0.005","90","","1679.8","1.3","294","2","294","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C18 H19 F3 O3 -","- C18 H19 F3 O3 -","- C72 H76 F12 O12 -","4","1","","Wang, Tong; Ye, Song","Phosphine-catalyzed [3 + 2] cycloaddition of allenoates with trifluoromethylketones: synthesis of dihydrofurans and tetrahydrofurans.","Organic & biomolecular chemistry","2011","9","14","5260","5265","10.1039/c1ob05444a","","","0.71073","MoKα","","0.0887","0.0811","","","0.1772","0.1821","","","","","","1.246","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151936","10.396","0.002","10.88","0.002","19.224","0.004","90","","90","","90","","2174.4","0.7","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H16 O3 -","- C12 H16 O3 -","- C96 H128 O24 -","8","2","","Iqbal, Mudassar; Black, Richard J. G.; Winn, Joby; Reeder, Andrew T.; Blake, Alexander J.; Clarke, Paul A.","Studies on transannulation reactions across a nine-membered ring: the synthesis of natural product-like structures.","Organic & biomolecular chemistry","2011","9","14","5062","5078","10.1039/c1ob05448a","","","0.71073","MoKα","","0.0466","0.0398","","","0.0871","0.0896","","","","","","0.99","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151937","24.17","0.004","7.6936","0.0012","12.38","0.002","90","","112.922","0.003","90","","2120.3","0.6","150","2","150","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C12 H16 O3 -","- C12 H16 O3 -","- C96 H128 O24 -","8","2","","Iqbal, Mudassar; Black, Richard J. G.; Winn, Joby; Reeder, Andrew T.; Blake, Alexander J.; Clarke, Paul A.","Studies on transannulation reactions across a nine-membered ring: the synthesis of natural product-like structures.","Organic & biomolecular chemistry","2011","9","14","5062","5078","10.1039/c1ob05448a","","","0.71073","MoKα","","0.0637","0.0487","","","0.114","0.121","","","","","","0.96","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151938","11.6786","0.0003","14.5262","0.0004","8.7114","0.0002","90","","103.82","0.001","90","","1435.07","0.06","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Methyl 1-(3-(1-napththyl)-3-oxopropanoyl)cyclopropanecarboxylate","","- C18 H16 O4 -","- C18 H16 O4 -","- C72 H64 O16 -","4","1","","Rahn, Thomas; Bendrath, Franziska; Hein, Martin; Baumann, Wolfgang; Jiao, Haijun; Börner, Armin; Villinger, Alexander; Langer, Peter","Synthesis and characterization of bis-cyclopropanated 1,3,5-tricarbonyl compounds. A combined synthetic, spectroscopic and theoretical study.","Organic & biomolecular chemistry","2011","9","14","5172","5184","10.1039/c1ob05455d","","","0.71073","MoKα","","0.0509","0.0434","","","0.1267","0.1322","","","","","","1.058","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151939","9.4464","0.0003","8.3079","0.0003","19.3443","0.0007","90","","94.272","0.002","90","","1513.92","0.09","173","2","173","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","Methyl 1-(1-(4-methoxybenzoyl)cyclopropanecarbonyl)cyclopropanecarboxylate","","- C17 H18 O5 -","- C17 H18 O5 -","- C68 H72 O20 -","4","1","","Rahn, Thomas; Bendrath, Franziska; Hein, Martin; Baumann, Wolfgang; Jiao, Haijun; Börner, Armin; Villinger, Alexander; Langer, Peter","Synthesis and characterization of bis-cyclopropanated 1,3,5-tricarbonyl compounds. A combined synthetic, spectroscopic and theoretical study.","Organic & biomolecular chemistry","2011","9","14","5172","5184","10.1039/c1ob05455d","","","0.71073","MoKα","","0.056","0.0416","","","0.1063","0.1133","","","","","","1.033","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151940","7.8373","0.0007","8.6462","0.0008","13.3583","0.0012","90","","94.152","0.002","90","","902.82","0.14","223","2","223","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H22 O5 S -","- C19 H22 O5 S -","- C38 H44 O10 S2 -","2","1","","Ren, Qiao; Gao, Yaojun; Wang, Jian","Chiral indane skeleton based thiourea catalyzed highly stereoselective cascade Michael-enolation-cyclization reaction.","Organic & biomolecular chemistry","2011","9","14","5297","5302","10.1039/c1ob05477e","","","0.71073","MoKα","","0.0447","0.0428","","","0.1088","0.1102","","","","","","1.076","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151941","11.543","0.004","19.853","0.007","12.183","0.005","90","","97.935","0.004","90","","2765.2","1.8","173","2","173","2","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- C56 H34 N6 O2 -","- C56 H34 N6 O2 -","- C112 H68 N12 O4 -","2","0.5","","Hu, Shu-Zhen; Chen, Chuan-Feng","Hg(2+) recognition by triptycene-derived heteracalixarenes: selectivity tuned by bridging heteroatoms and macrocyclic cavity.","Organic & biomolecular chemistry","2011","9","16","5838","5844","10.1039/c1ob05515a","","","0.71073","MoKα","","0.1157","0.0948","","","0.2137","0.2254","","","","","","1.117","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151942","7.128","0.0004","7.3609","0.0004","10.9238","0.0006","90.492","0.003","98.609","0.003","112.463","0.003","522.34","0.05","120","2","120","2","","","","","","","","5","P -1","-P 1","2","Methyl 5,6-dibromo-1H-indole-3-carboxylate","Methyl 5,6-dibromo-1H-indole-3-carboxylate","","- C10 H7 Br2 N O2 -","- C10 H7 Br2 N O2 -","- C20 H14 Br4 N2 O4 -","2","1","","Parsons, Thomas B.; Ghellamallah, Cédric; Male, Louise; Spencer, Neil; Grainger, Richard S.","Regioselective dibromination of methyl indole-3-carboxylate and application in the synthesis of 5,6-dibromoindoles.","Organic & biomolecular chemistry","2011","9","14","5021","5023","10.1039/c1ob05522d","","","0.71073","MoKα","","0.0358","0.0276","","","0.0559","0.0598","","","","","","1.089","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151943","7.0596","0.0003","10.693","0.0004","11.4729","0.0004","96.062","0.002","94.194","0.002","106.037","0.002","822.95","0.06","120","2","120","2","","","","","","","","5","P -1","-P 1","2","1-tert-Butyl-3-methyl 5,6-dibromo-1H-indole-1,3-dicarboxylate","1-tert-Butyl-3-methyl 5,6-dibromo-1H-indole-1,3-dicarboxylate","","- C15 H15 Br2 N O4 -","- C15 H15 Br2 N O4 -","- C30 H30 Br4 N2 O8 -","2","1","","Parsons, Thomas B.; Ghellamallah, Cédric; Male, Louise; Spencer, Neil; Grainger, Richard S.","Regioselective dibromination of methyl indole-3-carboxylate and application in the synthesis of 5,6-dibromoindoles.","Organic & biomolecular chemistry","2011","9","14","5021","5023","10.1039/c1ob05522d","","","0.71073","MoKα","","0.0585","0.0387","","","0.0701","0.0763","","","","","","1.067","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151944","11.0874","0.0006","7.5403","0.0004","18.872","0.001","90","","90","","90","","1577.74","0.15","150","2","150","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","5,6-Dibromo-1H-indole","5,6-Dibromo-1H-indole","","- C8 H5 Br2 N -","- C8 H5 Br2 N -","- C64 H40 Br16 N8 -","8","1","","Parsons, Thomas B.; Ghellamallah, Cédric; Male, Louise; Spencer, Neil; Grainger, Richard S.","Regioselective dibromination of methyl indole-3-carboxylate and application in the synthesis of 5,6-dibromoindoles.","Organic & biomolecular chemistry","2011","9","14","5021","5023","10.1039/c1ob05522d","","","1.54184","CuKα","","0.0281","0.0279","","","0.0777","0.0778","","","","","","1.197","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151945","8.8688","0.0004","6.0886","0.0003","16.8852","0.0008","90","","91.443","0.003","90","","911.49","0.07","150","2","150","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","3,5,6-Tribromo-1H-indole","3,5,6-Tribromo-1H-indole","","- C8 H4 Br3 N -","- C8 H4 Br3 N -","- C32 H16 Br12 N4 -","4","1","","Parsons, Thomas B.; Ghellamallah, Cédric; Male, Louise; Spencer, Neil; Grainger, Richard S.","Regioselective dibromination of methyl indole-3-carboxylate and application in the synthesis of 5,6-dibromoindoles.","Organic & biomolecular chemistry","2011","9","14","5021","5023","10.1039/c1ob05522d","","","1.54184","CuKα","","0.0254","0.0251","","","0.0663","0.0666","","","","","","1.097","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151946","7.6033","0.0004","8.0327","0.0004","9.661","0.0005","68.061","0.003","66.835","0.003","73.873","0.003","497.24","0.05","120","2","120","2","","","","","","","","4","P -1","-P 1","2","3,5,6-Tribromo-N-methyl-1H-indole","3,5,6-Tribromo-N-methyl-1H-indole","","- C9 H6 Br3 N -","- C9 H6 Br3 N -","- C18 H12 Br6 N2 -","2","1","","Parsons, Thomas B.; Ghellamallah, Cédric; Male, Louise; Spencer, Neil; Grainger, Richard S.","Regioselective dibromination of methyl indole-3-carboxylate and application in the synthesis of 5,6-dibromoindoles.","Organic & biomolecular chemistry","2011","9","14","5021","5023","10.1039/c1ob05522d","","","1.54178","CuKα","","0.0236","0.0234","","","0.0619","0.0621","","","","","","1.175","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151947","16.4115","0.0013","8.1684","0.0005","17.6258","0.0013","90","","96.614","0.003","90","","2347.1","0.3","103","2","103","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C46 H64 N6 O7 Si2 -","- C46 H64 N6 O7 Si2 -","- C92 H128 N12 O14 Si4 -","2","1","","Sacchetti, Alessandro; Silvani, Alessandra; Gatti, Francesco G.; Lesma, Giordano; Pilati, Tullio; Trucchi, Beatrice","Addition of TMSCN to chiral ketimines derived from isatin. Synthesis of an oxindole-based peptidomimetic and a bioactive spirohydantoin.","Organic & biomolecular chemistry","2011","9","15","5515","5522","10.1039/c1ob05532a","","","0.71073","MoKα","","0.0467","0.0356","","","0.0829","0.0896","","","","","","1.028","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151948","11.18","0.003","9.4995","0.0018","12.049","0.003","90","","111.894","0.005","90","","1187.4","0.5","223","2","223","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","1-(1-(4-chlorophenyl)ethyl)pyrrolidin-2-one","","","- C12 H15 Cl N2 O -","- C12 H15 Cl N2 O -","- C48 H60 Cl4 N8 O4 -","4","1","","Jiang, Ran; Xu, Hai-Yan; Xu, Xiao-Ping; Chu, Xue-Qiang; Ji, Shun-Jun","Direct alkylation of indoles and amines by tert-enamides: facile access to pharmaceutically active 2-oxo-1-pyrrolidine analogues.","Organic & biomolecular chemistry","2011","9","16","5659","5669","10.1039/c1ob05546a","","","0.71075","MoKα","","0.0731","0.0529","","","0.1287","0.1404","","","","","","1.096","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151949","9.0917","0.0008","9.8531","0.0009","29.228","0.002","90","","90","","90","","2618.3","0.4","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H39 N5 O8 -","- C21 H39 N5 O8 -","- C84 H156 N20 O32 -","4","1","","Srinivas, Deekonda; Vijayadas, Kuruppanthara N.; Gonnade, Rajesh; Phalgune, Usha D.; Rajamohanan, Pattuparambil R.; Sanjayan, Gangadhar J.","Concurrent display of both α- and β-turns in a model peptide.","Organic & biomolecular chemistry","2011","9","16","5762","5765","10.1039/c1ob05553d","","","0.71073","MoKα","","0.0855","0.0641","","","0.1324","0.1411","","","","","","1.116","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151950","4.7957","0.0014","19.605","0.006","9.913","0.003","90","","100.076","0.004","90","","917.6","0.5","297","2","297","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C18 H24 N4 O4 -","- C18 H24 N4 O4 -","- C36 H48 N8 O8 -","2","1","","Srinivas, Deekonda; Vijayadas, Kuruppanthara N.; Gonnade, Rajesh; Phalgune, Usha D.; Rajamohanan, Pattuparambil R.; Sanjayan, Gangadhar J.","Concurrent display of both α- and β-turns in a model peptide.","Organic & biomolecular chemistry","2011","9","16","5762","5765","10.1039/c1ob05553d","","","0.71073","MoKα","","0.0537","0.0505","","","0.1348","0.1377","","","","","","1.07","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151951","9.056","0.005","9.842","0.004","29.153","0.017","90","","90","","90","","2598","2","297","2","297","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H39 N5 O8 -","- C21 H39 N5 O8 -","- C84 H156 N20 O32 -","4","1","","Srinivas, Deekonda; Vijayadas, Kuruppanthara N.; Gonnade, Rajesh; Phalgune, Usha D.; Rajamohanan, Pattuparambil R.; Sanjayan, Gangadhar J.","Concurrent display of both α- and β-turns in a model peptide.","Organic & biomolecular chemistry","2011","9","16","5762","5765","10.1039/c1ob05553d","","","0.71073","MoKα","","0.1032","0.0711","","","0.1383","0.1512","","","","","","1.083","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151952","8.1115","0.0003","5.6573","0.0002","18.0697","0.0007","90","","92.887","0.003","90","","828.15","0.05","120","2","120","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C19 H14 Cl2 O3 -","- C19 H14 Cl2 O3 -","- C38 H28 Cl4 O6 -","2","1","","Zhang, Qi; Xiao, Xiao; Lin, Lili; Liu, Xiaohua; Feng, Xiaoming","Highly enantioselective synthesis of γ-substituted butenolides via the vinylogous Mukaiyama-Michael reaction catalyzed by a chiral scandium(iii)-N,N'-dioxide complex.","Organic & biomolecular chemistry","2011","9","16","5748","5754","10.1039/c1ob05558e","","","0.7107","MoKα","","0.0318","0.0273","","","0.0591","0.0602","","","","","","0.914","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151953","9.0593","0.0003","15.3579","0.0005","19.9706","0.0006","90","","90","","90","","2778.55","0.15","100","","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","(6R)-2,6-anhydro-4-O-[tert-butyl(dimethyl)silyl]-3-deoxy -1-(methoxyamino)-3-(methoxycarbonyl)-5-O-(methoxymethyl) -5-C-methyl-6-pentyl-L-reythro-hex-2-enose","","- C23 H43 N O8 Si -","- C23 H43 N O8 Si -","- C92 H172 N4 O32 Si4 -","4","1","","Kobayashi, Kenichi; Okamoto, Iwao; Morita, Nobuyoshi; Kiyotani, Tamiko; Tamura, Osamu","Synthesis of the proposed structure of phaeosphaeride A.","Organic & biomolecular chemistry","2011","9","16","5825","5832","10.1039/c1ob05612c","","","1.54187","CuKα","","0.0713","0.0569","","","0.1155","0.1255","","","","","","1.018","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151954","9.4142","0.0009","16.609","0.0017","16.8295","0.0017","90","","105.173","0.001","90","","2539.7","0.4","296","2","296","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C30 H28 Cl2 N2 -","- C30 H28 Cl2 N2 -","- C120 H112 Cl8 N8 -","4","1","","Yang, Yan-Fang; Shu, Xing-Zhong; Wei, Hai-Long; Luo, Jian-Yi; Ali, Shaukat; Liu, Xue-Yuan; Liang, Yong-Min","FeCl(3)-Mediated synthesis of polysubstituted tetrahydroquinolines via domino Mannich/Friedel-Crafts reactions of aldehydes and amines.","Organic & biomolecular chemistry","2011","9","14","5028","5033","10.1039/c1ob05646h","","","0.71073","MoKα","","0.0603","0.04","","","0.0957","0.1067","","","","","","1.035","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151955","11.4767","0.0003","9.9382","0.0003","14.0372","0.0005","90","","92.646","0.003","90","","1599.34","0.09","120","2","120","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C10 H16 Cl3 N5 O Zn -","- C10 H16 Cl3 N5 O Zn -","- C40 H64 Cl12 N20 O4 Zn4 -","4","1","","Trávníček, Zdeněk; Novotná, Radka; Marek, Jaromír; Popa, Igor; Sipl, Michal","Transformations of the natural cytokinin N6-isopentenyladenine in aqueous acidic media: structural aspects.","Organic & biomolecular chemistry","2011","9","16","5703","5713","10.1039/c1ob05649b","","","0.7107","MoKα","","0.0418","0.0413","","","0.0904","0.0905","","","","","","1.591","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7151956","8.3518","0.0003","10.0642","0.0005","21.5006","0.001","96.082","0.004","94.259","0.004","112.541","0.004","1646.72","0.14","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C20 H28 Cl8 N10 Zn3 -","- C20 H28 Cl8 N10 Zn3 -","- C40 H56 Cl16 N20 Zn6 -","2","1","","Trávníček, Zdeněk; Novotná, Radka; Marek, Jaromír; Popa, Igor; Sipl, Michal","Transformations of the natural cytokinin N6-isopentenyladenine in aqueous acidic media: structural aspects.","Organic & biomolecular chemistry","2011","9","16","5703","5713","10.1039/c1ob05649b","","","0.7107","MoKα","","0.0223","0.0214","","","0.0695","0.0702","","","","","","1.169","","","","has coordinates,has disorder","176432","2020-10-21","18:00:00",""
"7151957","7.0591","0.0004","15.6552","0.0007","13.2731","0.0006","90","","98.24","0.005","90","","1451.69","0.12","120","2","120","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C9 H21 Cl2 N5 O2 -","- C9 H21 Cl2 N5 O2 -","- C36 H84 Cl8 N20 O8 -","4","1","","Trávníček, Zdeněk; Novotná, Radka; Marek, Jaromír; Popa, Igor; Sipl, Michal","Transformations of the natural cytokinin N6-isopentenyladenine in aqueous acidic media: structural aspects.","Organic & biomolecular chemistry","2011","9","16","5703","5713","10.1039/c1ob05649b","","","0.71073","MoKα","","0.0278","0.0261","","","0.0674","0.0684","","","","","","1.076","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151958","7.6673","0.0004","7.8804","0.0005","13.4349","0.0007","101.599","0.005","91.479","0.004","91.095","0.005","794.67","0.08","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H17 Cl4 Cu N5 -","- C9 H17 Cl4 Cu N5 -","- C18 H34 Cl8 Cu2 N10 -","2","1","","Trávníček, Zdeněk; Novotná, Radka; Marek, Jaromír; Popa, Igor; Sipl, Michal","Transformations of the natural cytokinin N6-isopentenyladenine in aqueous acidic media: structural aspects.","Organic & biomolecular chemistry","2011","9","16","5703","5713","10.1039/c1ob05649b","","","0.71073","MoKα","","0.0366","0.0352","","","0.0944","0.0955","","","","","","1.075","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7151959","7.8356","0.0004","13.1475","0.0006","15.8482","0.0009","76.546","0.004","84.994","0.004","81.751","0.004","1568.96","0.14","120","2","120","2","","","","","","","","5","P -1","-P 1","2","","","","- C9 H17 Cl4 N5 Zn -","- C9 H17 Cl4 N5 Zn -","- C36 H68 Cl16 N20 Zn4 -","4","2","","Trávníček, Zdeněk; Novotná, Radka; Marek, Jaromír; Popa, Igor; Sipl, Michal","Transformations of the natural cytokinin N6-isopentenyladenine in aqueous acidic media: structural aspects.","Organic & biomolecular chemistry","2011","9","16","5703","5713","10.1039/c1ob05649b","","","0.71073","MoKα","","0.0432","0.0403","","","0.1079","0.11","","","","","","0.984","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7151960","8.5748","0.0006","14.9184","0.001","23.0172","0.0015","90","","90","","90","","2944.4","0.3","296","2","296","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C26 H35 N5 O11 S -","- C26 H33 N5 O11 S -","- C104 H132 N20 O44 S4 -","4","1","","Shen, Fengjuan; Li, Xiaoliu; Zhang, Xiaoyuan; Yin, Qingmei; Qin, Zhanbin; Chen, Hua; Zhang, Jinchao; Ma, Zhaipu","Microwave-assisted synthesis of dinucleoside analogues containing a thiazolidin-4-one linkage via one-pot tandem Staudinger/aza-Wittig/cyclization.","Organic & biomolecular chemistry","2011","9","16","5766","5772","10.1039/c1ob05675a","","","0.71073","MoKα","","0.1144","0.0591","","","0.1498","0.1773","","","","","","1.03","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151961","16.0335","0.0017","9.3932","0.001","15.1","0.0016","90","","109.749","0.002","90","","2140.4","0.4","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 Br N2 O -","- C25 H27 Br N2 O -","- C100 H108 Br4 N8 O4 -","4","1","","Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.","Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.","Organic & biomolecular chemistry","2011","9","14","5104","5108","10.1039/c1ob05710c","","","0.71073","MoKα","","0.08","0.0439","","","0.079","0.1093","","","","","","0.905","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151962","8.197","0.002","22.507","0.006","12.208","0.003","90","","101.368","0.004","90","","2208.1","1","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C25 H27 Br N2 O -","- C25 H27 Br N2 O -","- C100 H108 Br4 N8 O4 -","4","1","","Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.","Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.","Organic & biomolecular chemistry","2011","9","14","5104","5108","10.1039/c1ob05710c","","","0.71073","MoKα","","0.0461","0.0354","","","0.0782","0.0817","","","","","","1.096","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151963","13.9702","0.0009","9.4045","0.0006","18.4052","0.0012","90","","94.432","0.001","90","","2410.9","0.3","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C27 H27 Br N2 O2 S -","- C27 H27 Br N2 O2 S -","- C108 H108 Br4 N8 O8 S4 -","4","1","","Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.","Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.","Organic & biomolecular chemistry","2011","9","14","5104","5108","10.1039/c1ob05710c","","","0.71073","MoKα","","0.0533","0.0356","","","0.0772","0.0928","","","","","","0.958","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151964","13.7253","0.0011","10.4969","0.0008","16.7159","0.0013","90","","102.557","0.002","90","","2350.7","0.3","180","2","180","2","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C50 H62 N4 O9 -","- C50 H62 N4 O9 -","- C100 H124 N8 O18 -","2","0.5","","Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.","Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.","Organic & biomolecular chemistry","2011","9","14","5104","5108","10.1039/c1ob05710c","","","0.71073","MoKα","","0.1423","0.0661","","","0.1864","0.2116","","","","","","0.845","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151965","9.903","0.0013","10.8311","0.0014","19.231","0.002","90","","90","","90","","2062.7","0.4","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H23 N3 O4 -","- C24 H23 N3 O4 -","- C96 H92 N12 O16 -","4","1","","Coote, Susannah C.; Quenum, Seidjolo; Procter, David J.","Exploiting Sm(ii) and Sm(iii) in SmI(2)-initiated reaction cascades: application in a tag removal-cyclisation approach to spirooxindole scaffolds.","Organic & biomolecular chemistry","2011","9","14","5104","5108","10.1039/c1ob05710c","","","0.71073","MoKα","","0.0554","0.0445","","","0.0786","0.0817","","","","","","1.043","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151966","11.3829","0.0013","12.3833","0.0015","13.4311","0.0016","90","","90","","90","","1893.2","0.4","296","2","296","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H28 N2 O6 -","- C20 H28 N2 O6 -","- C80 H112 N8 O24 -","4","1","","Chen, Jia; Chen, Jian-Jun; Yao, Xiaojun; Gao, Kun","Kopsihainanines A and B, two unusual alkaloids from Kopsia hainanensis.","Organic & biomolecular chemistry","2011","9","15","5334","5336","10.1039/c1ob05724c","","","0.71073","MoKα","","0.0786","0.0447","","","0.0795","0.0898","","","","","","1.101","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151967","9.84534","0.00019","13.7667","0.0003","35.643","0.0007","90","","90","","90","","4830.98","0.17","203.1","","203","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C37 H69 N5 O6 Si4 -","- C37 H69 N5 O6 Si4 -","- C148 H276 N20 O24 Si16 -","4","1","","Meng, Xiangtai; Moriuchi, Toshiyuki; Tohnai, Norimitsu; Miyata, Mikiji; Kawahata, Masatoshi; Yamaguchi, Kentaro; Hirao, Toshikazu","Synthesis and assembling properties of bioorganometallic cyclometalated Au(iii) alkynyls bearing guanosine moieties.","Organic & biomolecular chemistry","2011","9","16","5633","5636","10.1039/c1ob05842h","","","1.54187","CuKα","","","0.0718","","","","0.1962","","","","","","0.913","","","","has coordinates","202017","2020-10-21","18:00:00",""
"7151968","46.284","0.003","12.2793","0.0007","11.1201","0.0007","90","","90","","90","","6319.9","0.7","100","","100","","","","","","","","Synthesized by the authors. See text","6","P b c n","-P 2n 2ab","60","","","","- C32 H42 N O2 P Si -","- C32 H42 N O2 P Si -","- C256 H336 N8 O16 P8 Si8 -","8","1","","Oberg, Elisabet; Geng, Xue-Li; Santoni, Marie-Pierre; Ott, Sascha","C,C-Diacetylenic phosphaalkenes in palladium-catalyzed cross-coupling reactions.","Organic & biomolecular chemistry","2011","9","18","6246","6255","10.1039/c1ob05705g","","","0.71073","MoKα","","0.1212","0.0732","","","0.2194","0.2376","","","","","","1.058","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151969","11.502","0.002","11.404","0.002","23.465","0.005","90","","93.2","0.03","90","","3073.1","1","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H38 Cl2 Si4 -","- C22 H38 Cl2 Si4 -","- C88 H152 Cl8 Si16 -","4","1","","Oberg, Elisabet; Geng, Xue-Li; Santoni, Marie-Pierre; Ott, Sascha","C,C-Diacetylenic phosphaalkenes in palladium-catalyzed cross-coupling reactions.","Organic & biomolecular chemistry","2011","9","18","6246","6255","10.1039/c1ob05705g","","","0.71073","MoKα","","0.1575","0.1168","","","0.3644","0.3912","","","","","","1.153","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151970","18.725","0.001","10.407","0.0009","12.115","0.0014","90","","122.302","0.001","90","","1995.5","0.3","296","2","296","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","Fused Butenolides","","","- C10 H12 O4 -","- C10 H12 O4 -","- C80 H96 O32 -","8","1","","Patel, Ramesh M.; Puranik, Vedavati G.; Argade, Narshinha P.","Regio- and stereoselective selenium dioxide allylic oxidation of (E)-dialkyl alkylidenesuccinates to (Z)-allylic alcohols: Synthesis of natural and unnatural butenolides.","Organic & biomolecular chemistry","2011","9","18","6312","6322","10.1039/c1ob05709j","","","0.71073","MoKα","","0.0539","0.0483","","","0.1156","0.1197","","","","","","1.071","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151971","6.1283","0.0007","8.0991","0.001","22.952","0.003","90","","92.622","0.002","90","","1138","0.2","296","2","296","2","","","","","","","","3","P 1 21/n 1","-P 2yn","14","Fused Butenolides","","","- C11 H16 O4 -","- C11 H16 O4 -","- C44 H64 O16 -","4","1","","Patel, Ramesh M.; Puranik, Vedavati G.; Argade, Narshinha P.","Regio- and stereoselective selenium dioxide allylic oxidation of (E)-dialkyl alkylidenesuccinates to (Z)-allylic alcohols: Synthesis of natural and unnatural butenolides.","Organic & biomolecular chemistry","2011","9","18","6312","6322","10.1039/c1ob05709j","","","0.71073","MoKα","","0.0906","0.0617","","","0.1502","0.1649","","","","","","1.092","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151972","5.0397","0.0003","14.3513","0.001","10.316","0.0007","90","","98.118","0.001","90","","738.64","0.08","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","Butenolides","","","- C7 H8 O4 -","- C7 H8 O4 -","- C28 H32 O16 -","4","1","","Patel, Ramesh M.; Puranik, Vedavati G.; Argade, Narshinha P.","Regio- and stereoselective selenium dioxide allylic oxidation of (E)-dialkyl alkylidenesuccinates to (Z)-allylic alcohols: Synthesis of natural and unnatural butenolides.","Organic & biomolecular chemistry","2011","9","18","6312","6322","10.1039/c1ob05709j","","","0.71073","MoKα","","0.0678","0.0658","","","0.1684","0.1702","","","","","","1.11","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151973","10.4595","0.001","8.2649","0.0008","13.4821","0.0013","90","","110.602","0.002","90","","1090.95","0.18","296","2","296","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","chromene","","","- C11 H16 O4 -","- C11 H16 O4 -","- C44 H64 O16 -","4","1","","Patel, Ramesh M.; Puranik, Vedavati G.; Argade, Narshinha P.","Regio- and stereoselective selenium dioxide allylic oxidation of (E)-dialkyl alkylidenesuccinates to (Z)-allylic alcohols: Synthesis of natural and unnatural butenolides.","Organic & biomolecular chemistry","2011","9","18","6312","6322","10.1039/c1ob05709j","","","0.71073","MoKα","","0.0495","0.0395","","","0.0998","0.1071","","","","","","1.047","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151974","16.1331","0.0014","37.634","0.003","17.1581","0.0015","90","","98.715","0.002","90","","10297.3","1.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C87 H123 N7 O9 -","- C87 H123 N7 O9 -","- C348 H492 N28 O36 -","4","1","","Cornut, Damien; Marrot, Jérôme; Wouters, Johan; Jabin, Ivan","Acid-base modulation of a versatile heteroditopic calix[6]arene based receptor.","Organic & biomolecular chemistry","2011","9","18","6373","6384","10.1039/c1ob05759f","","","0.71073","MoKα","","0.1499","0.0822","","","0.2253","0.2463","","","","","","1.048","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151975","15.853","0.0013","15.5929","0.0015","25.462","0.002","90","","115.951","0.006","90","","5659.4","0.9","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C72 H70 N4 O2 -","- C72 H70 N4 O2 -","- C288 H280 N16 O8 -","4","1","","Keller, Stephan; Yi, Chenyi; Li, Chen; Liu, Shi-Xia; Blum, Carmen; Frei, Gabriela; Sereda, Olha; Neels, Antonia; Wandlowski, Thomas; Decurtins, Silvio","Synthesis, structures, redox and photophysical properties of benzodifuran-functionalised pyrene and anthracene fluorophores.","Organic & biomolecular chemistry","2011","9","18","6410","6416","10.1039/c1ob05778b","","","0.71073","MoKα","","0.3205","0.0669","","","0.1052","0.1745","","","","","","0.668","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151976","13.7947","0.0009","9.0999","0.0006","22.2042","0.0016","90","","105.631","0.005","90","","2684.2","0.3","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C68 H70 N4 O2 -","- C68 H70 N4 O2 -","- C136 H140 N8 O4 -","2","0.5","","Keller, Stephan; Yi, Chenyi; Li, Chen; Liu, Shi-Xia; Blum, Carmen; Frei, Gabriela; Sereda, Olha; Neels, Antonia; Wandlowski, Thomas; Decurtins, Silvio","Synthesis, structures, redox and photophysical properties of benzodifuran-functionalised pyrene and anthracene fluorophores.","Organic & biomolecular chemistry","2011","9","18","6410","6416","10.1039/c1ob05778b","","","0.71073","MoKα","","0.1494","0.0677","","","0.147","0.1723","","","","","","0.86","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151977","12.0856","0.001","17.2822","0.0016","16.4631","0.0016","90","","129.164","0.006","90","","2666.1","0.5","173","2","173","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C68 H70 N4 O2 -","- C68 H70 N4 O2 -","- C136 H140 N8 O4 -","2","0.5","","Keller, Stephan; Yi, Chenyi; Li, Chen; Liu, Shi-Xia; Blum, Carmen; Frei, Gabriela; Sereda, Olha; Neels, Antonia; Wandlowski, Thomas; Decurtins, Silvio","Synthesis, structures, redox and photophysical properties of benzodifuran-functionalised pyrene and anthracene fluorophores.","Organic & biomolecular chemistry","2011","9","18","6410","6416","10.1039/c1ob05778b","","","0.71073","MoKα","","0.1715","0.0527","","","0.0803","0.1006","","","","","","0.686","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151978","14.5009","0.0018","16.212","0.002","14.5134","0.0018","97.198","0.002","99.991","0.002","86.541","0.002","3331.1","0.7","293","2","293","2","","","","","","","","3","P -1","-P 1","2","C60C6H4Cl5Cl_toluene","C60C6H4Cl5Cl_toluene","","- C97 H28 Cl6 -","- C97 H28 Cl6 -","- C194 H56 Cl12 -","2","1","","Hashiguchi, Masahiko; Watanabe, Kazuhiro; Matsuo, Yutaka","Facile fullerene modification: FeCl(3)-mediated quantitative conversion of C(60) to polyarylated fullerenes containing pentaaryl(chloro)[60]fullerenes.","Organic & biomolecular chemistry","2011","9","18","6417","6421","10.1039/c1ob05895a","","","0.71073","MoKα","","0.1994","0.1051","","","0.2953","0.3703","","","","","","1.102","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151979","20.3125","0.0012","20.3125","0.0012","15.9673","0.0011","90","","90","","120","","5705.4","0.6","291","2","291","2","","","","","","","","5","R 3 :H","R 3","146","","","","- C25 H24 Br N O3 -","- C25 H24 Br N O3 -","- C225 H216 Br9 N9 O27 -","9","1","","Ni, Cheng-Yan; Kan, Sha-Sha; Liu, Quan-Zhong; Kang, Tai-Ran","Diastereoselective and enantioselective capture of chiral zinc enolate using nitroolefins: a rapid access to chiral γ-nitro carbonyl compounds.","Organic & biomolecular chemistry","2011","9","18","6211","6214","10.1039/c1ob05903c","","","1.54184","CuKα","","0.1031","0.0842","","","0.1875","0.198","","","","","","1.082","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151980","7.4163","0.0003","14.0432","0.0006","25.9274","0.001","90","","90","","90","","2700.3","0.19","291","2","291","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C32 H33 N O2 S -","- C32 H33 N O2 S -","- C128 H132 N4 O8 S4 -","4","1","","Ni, Cheng-Yan; Kan, Sha-Sha; Liu, Quan-Zhong; Kang, Tai-Ran","Diastereoselective and enantioselective capture of chiral zinc enolate using nitroolefins: a rapid access to chiral γ-nitro carbonyl compounds.","Organic & biomolecular chemistry","2011","9","18","6211","6214","10.1039/c1ob05903c","","","0.71073","MoKα","","0.089","0.0517","","","0.0886","0.1012","","","","","","1.012","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151981","19.4658","0.0004","7.8017","0.0001","15.153","0.0003","90","","110.941","0.001","90","","2149.23","0.07","293","","293","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","6-phenyl-4H-pyrido(1,2-a)pyrimidin-4-one","6-phenyl-4H-pyrido[1,2-a]pyrimidin-4-one","","- C14 H10 N2 O -","- C14 H10 N2 O -","- C112 H80 N16 O8 -","8","1","","Molnár, Annamária; Kapros, Anita; Párkányi, László; Mucsi, Zoltán; Vlád, Gábor; Hermecz, István","Suzuki-Miyaura cross-coupling reactions of halo derivatives of 4H-pyrido[1,2-a]pyrimidin-4-ones.","Organic & biomolecular chemistry","2011","9","19","6559","6565","10.1039/c1ob05505d","","","1.54187","CuKα","","0.0438","0.0342","","","0.0874","0.0968","","","","","","1.097","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151982","16.3465","0.0011","23.3116","0.0018","17.2917","0.0013","90","","116.247","0.007","90","","5909.9","0.8","293","1","293","1","","","","","","","","5","C 1 c 1","C -2yc","9","Cone-5d","","","- C63 H66 F9 N3 O9 -","- C63 H66 F9 N3 O9 -","- C252 H264 F36 N12 O36 -","4","1","","Ni, Xin-Long; Rahman, Shofuir; Zeng, Xi; Hughes, David L.; Redshaw, Carl; Yamato, Takehiko","Novel ion-pair receptors based on hexahomotrioxacalix[3]arene derivatives.","Organic & biomolecular chemistry","2011","9","19","6535","6541","10.1039/c1ob05564j","","","0.71073","Mo-Kα","","0.0848","0.0563","","","0.1292","0.1402","","","","","","1.042","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151983","11.411","0.004","15.482","0.005","16.504","0.007","92.63","0.03","97.69","0.03","106.65","0.03","2757.4","1.8","293","2","140","1","","","","","","","","5","P -1","-P 1","2","Cone-5c","","","- C60 H66 F3 N3 O9 -","- C60 H66 F3 N3 O9 -","- C120 H132 F6 N6 O18 -","2","1","","Ni, Xin-Long; Rahman, Shofuir; Zeng, Xi; Hughes, David L.; Redshaw, Carl; Yamato, Takehiko","Novel ion-pair receptors based on hexahomotrioxacalix[3]arene derivatives.","Organic & biomolecular chemistry","2011","9","19","6535","6541","10.1039/c1ob05564j","","","0.71073","Mo-Kα","","0.3008","0.2672","","","0.5722","0.5898","","","","","","2.321","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151984","11.2799","0.0006","15.1788","0.0009","21.4815","0.0013","90","","90","","90","","3678","0.4","140","1","140","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Compound 41","","","- C33 H42 Cl2 O17 -","- C33 H42 Cl2 O17 -","- C132 H168 Cl8 O68 -","4","1","","Nepogodiev, Sergey A.; Fais, Margherita; Hughes, David L.; Field, Robert A.","Synthesis of apiose-containing oligosaccharide fragments of the plant cell wall: fragments of rhamnogalacturonan-II side chains A and B, and apiogalacturonan.","Organic & biomolecular chemistry","2011","9","19","6670","6684","10.1039/c1ob05587a","","","0.71073","Mo-Kα","","0.0486","0.0372","","","0.0894","0.0925","","","","","","1.048","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151985","28.965","0.014","36.811","0.018","15.395","0.016","90","","90","","90","","16415","2","100","2","100","2","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C159 H215 N8 O50.5 Rh4 -","- C158 H170 N8 O50.5 Rh4 -","- C632 H680 N32 O202 Rh16 -","4","1","","Mattiza, Jens T.; Fohrer, Joerg G. G.; Duddeck, Helmut; Gardiner, Michael G.; Ghanem, Ashraf","Optimizing dirhodium(ii) tetrakiscarboxylates as chiral NMR auxiliaries.","Organic & biomolecular chemistry","2011","9","19","6542","6550","10.1039/c1ob05665d","","","0.710673","Synchrotron","","0.0488","0.0418","","","0.1014","0.1054","","","","","","1.079","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151986","9.823","0.002","11.349","0.002","15.262","0.003","90","","97.43","0.03","90","","1687.1","0.6","113","2","113","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H15 Cl2 N O3 -","- C18 H15 Cl2 N O3 -","- C72 H60 Cl8 N4 O12 -","4","1","","Xie, Peizhong; Huang, You; Lai, Wenqing; Meng, Xiangtai; Chen, Ruyu","Bifunctional phosphine-catalyzed cross-Rauhut-Currier/Michael/aldol condensation triple domino reaction: synthesis of functionalized cyclohexenes.","Organic & biomolecular chemistry","2011","9","19","6707","6714","10.1039/c1ob05693j","","","1.54187","CuKα","","0.0596","0.059","","","0.1533","0.1539","","","","","","1.093","","","","has coordinates,has disorder","180305","2020-10-21","18:00:00",""
"7151987","6.9697","0.0014","9.891","0.002","13.577","0.003","91.1","0.03","103.89","0.03","109.35","0.03","852.3","0.4","113","2","113","2","","","","","","","","5","P -1","-P 1","2","","","","- C18 H15 Cl2 N O3 -","- C18 H15 Cl2 N O3 -","- C36 H30 Cl4 N2 O6 -","2","1","","Xie, Peizhong; Huang, You; Lai, Wenqing; Meng, Xiangtai; Chen, Ruyu","Bifunctional phosphine-catalyzed cross-Rauhut-Currier/Michael/aldol condensation triple domino reaction: synthesis of functionalized cyclohexenes.","Organic & biomolecular chemistry","2011","9","19","6707","6714","10.1039/c1ob05693j","","","1.54187","CuKα","","0.0456","0.0448","","","0.1248","0.1259","","","","","","1.054","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151988","9.7445","0.0002","9.7445","0.0002","37.3937","0.0005","90","","90","","120","","3075.02","0.1","150","","150","","","","","","","","synthesis as described","4","P 65","P 65","170","","","","- C23 H22 N2 O4 -","- C23 H22 N2 O4 -","- C138 H132 N12 O24 -","6","1","","Cowley, Andrew R.; Hill, Thomas J.; Kocis, Petr; Moloney, Mark G.; Stevenson, Robert D.; Thompson, Amber L.","Spirocyclic systems derived from pyroglutamic acid.","Organic & biomolecular chemistry","2011","9","20","7042","7056","10.1039/c1ob05708a","","","0.71073","MoKα","","","0.0474","","","","0.0555","","","","","","1.049","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7151989","10.5991","0.0004","6.3352","0.0002","11.6093","0.0005","90","","93.8504","0.0016","90","","777.77","0.05","150","","150","","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C17 H18 N2 O4 -","- C17 H18 N2 O4 -","- C34 H36 N4 O8 -","2","1","","Cowley, Andrew R.; Hill, Thomas J.; Kocis, Petr; Moloney, Mark G.; Stevenson, Robert D.; Thompson, Amber L.","Spirocyclic systems derived from pyroglutamic acid.","Organic & biomolecular chemistry","2011","9","20","7042","7056","10.1039/c1ob05708a","","","0.71073","MoKα","","","0.0313","","","","0.035","","","","","","1.0537","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7151990","10.34","0.003","9.733","0.003","18.073","0.005","90","","106.331","0.005","90","","1745.5","0.9","296","2","296","2","","","101.325","","","","Synthesis","4","P 1 21 1","P 2yb","4","(S,E)-ethyl 4-(tert-butoxycarbonylamino)-6-methylhept-2-enoate","(S,E)-ethyl 4-(tert-butoxycarbonylamino)-6-methylhept-2-enoate","","- C15 H27 N O4 -","- C15 H27 N O4 -","- C60 H108 N4 O16 -","4","2","","Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.","Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.","Organic & biomolecular chemistry","2011","9","19","6566","6574","10.1039/c1ob05732d","","x-ray","0.71073","MoKα","","0.0431","0.0341","","","0.0804","0.0896","","","","","","0.985","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151991","13.3376","0.0019","14.03","0.002","17.956","0.003","88.064","0.005","70.67","0.004","73.874","0.005","3039.6","0.8","100","2","100","2","","","101.325","","","","synthesis","4","P 1","P 1","1","alpha gamma mixed peptide","(S,E)-ethyl 4-((S)-2-(tert-butoxycarbonylamino)propanamido) -5-methylhex-2-enoate Chemical Formula: C17H30N2O5","","- C17 H30 N2 O5 -","- C17 H30 N2 O5 -","- C102 H180 N12 O30 -","6","6","","Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.","Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.","Organic & biomolecular chemistry","2011","9","19","6566","6574","10.1039/c1ob05732d","","x-ray","0.71073","MoKα","","0.1817","0.0881","","","0.1946","0.2449","","","","","","0.99","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151992","10.669","0.002","9.092","0.002","15.882","0.004","90","","90.923","0.005","90","","1540.4","0.6","296","2","296","2","","","101.325","","","","Synthesis","4","P 1 21/c 1","-P 2ybc","14","Boc-dgAib-OEt","(E)-ethyl 4-(tert-butoxycarbonylamino)-4-methylpent-2-enoate","","- C13 H24 N O4 -","- C13 H23 N O4 -","- C52 H92 N4 O16 -","4","1","","Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.","Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.","Organic & biomolecular chemistry","2011","9","19","6566","6574","10.1039/c1ob05732d","","x-ray","0.71073","MoKα","","0.1649","0.0651","","","0.1879","0.2427","","","","","","0.986","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151993","10.153","0.003","10.273","0.003","16.191","0.005","90","","90","","90","","1688.7","0.9","200","2","200","2","","","101.325","","","","Synthesis","4","P 21 21 21","P 2ac 2ab","19","Boc-dgI-OEt","(4S,5S,E)-ethyl 4-(tert-butoxycarbonylamino)-5-methylhept-2-enoate","","- C15 H27 N O4 -","- C15 H27 N O4 -","- C60 H108 N4 O16 -","4","1","","Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.","Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.","Organic & biomolecular chemistry","2011","9","19","6566","6574","10.1039/c1ob05732d","","x-ray","0.71073","MoKα","","0.0455","0.0378","","","0.0912","0.0961","","","","","","1.023","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151994","5.053","0.002","9.812","0.005","13.498","0.006","73.64","0.009","84.653","0.009","78.566","0.009","628.9","0.5","100","2","100","2","","","101.325","","","","Synthesis","4","P 1","P 1","1","","","","- C23 H40 N2 O5 -","- C23 H40 N2 O5 -","- C23 H40 N2 O5 -","1","1","","Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.","Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.","Organic & biomolecular chemistry","2011","9","19","6566","6574","10.1039/c1ob05732d","","x-ray","0.71073","MoKα","","0.1066","0.0663","","","0.1509","0.1751","","","","","","1.036","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151995","9.978","0.004","10.083","0.003","16.904","0.006","90","","90","","90","","1700.7","1","200","2","200","2","","","101.325","","","","Synthesis","4","P 21 21 21","P 2ac 2ab","19","Boc-dgV-OEt","(S,E)-ethyl 4-(tert-butoxycarbonylamino)-5-methylhex-2-enoate","","- C14 H25 N O4 -","- C14 H25 N O4 -","- C56 H100 N4 O16 -","4","1","","Mali, Sachitanand M.; Bandyopadhyay, Anupam; Jadhav, Sandip V.; Kumar, Mothukuri Ganesh; Gopi, Hosahudya N.","Synthesis of α, β-unsaturated γ-amino esters with unprecedented high (E)-stereoselectivity and their conformational analysis in peptides.","Organic & biomolecular chemistry","2011","9","19","6566","6574","10.1039/c1ob05732d","","x-ray","0.71073","MoKα","","0.1149","0.0581","","","0.1589","0.195","","","","","","1.003","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151996","27.199","0.003","6.8079","0.0008","16.539","0.002","90","","107.39","0.002","90","","2922.5","0.6","100","2","100","2","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C21 H14 N2 -","- C21 H14 N2 -","- C168 H112 N16 -","8","1","","Alajarin, Mateo; Bonillo, Baltasar; Ortin, Maria-Mar; Orenes, Raul-Angel; Vidal, Angel","Unprecedented intramolecular [3 + 2] cycloadditions of azido-ketenimines and azido-carbodiimides. Synthesis of indolo[1,2-a]quinazolines and tetrazolo[5,1-b]quinazolines.","Organic & biomolecular chemistry","2011","9","19","6741","6749","10.1039/c1ob05745f","","","0.71073","MoKα","","0.0602","0.054","","","0.1222","0.1259","","","","","","1.143","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151997","19.4794","0.0008","12.5963","0.0005","13.921","0.0006","90","","98.538","0.002","90","","3377.9","0.2","100","2","100","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C43 H34 Cl2 N4 O2 -","- C43 H34 Cl2 N4 O2 -","- C172 H136 Cl8 N16 O8 -","4","0.5","","Alajarin, Mateo; Bonillo, Baltasar; Ortin, Maria-Mar; Orenes, Raul-Angel; Vidal, Angel","Unprecedented intramolecular [3 + 2] cycloadditions of azido-ketenimines and azido-carbodiimides. Synthesis of indolo[1,2-a]quinazolines and tetrazolo[5,1-b]quinazolines.","Organic & biomolecular chemistry","2011","9","19","6741","6749","10.1039/c1ob05745f","","","0.71073","MoKα","","0.0589","0.0542","","","0.1384","0.1424","","","","","","1.017","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151998","11.7115","0.0011","14.9304","0.0015","11.9095","0.0012","90","","118.098","0.001","90","","1837","0.3","298","2","298","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H20 N2 O6 -","- C21 H20 N2 O6 -","- C84 H80 N8 O24 -","4","1","","Dou, Guolan; Shi, Daqing","One pot synthesis of cis-bispyrimidodiazepinone derivatives via low-valent titanium reagent (TiCl(4)/Sm).","Organic & biomolecular chemistry","2011","9","20","7065","7070","10.1039/c1ob05791j","","","0.71073","MoKα","","0.1054","0.0459","","","0.083","0.1058","","","","","","1.122","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7151999","7.779","0.0016","8.9198","0.0018","12.746","0.003","99.79","0.03","105.99","0.03","107.38","0.03","780.1","0.4","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","","","- C15 H19 O6 P -","- C15 H19 O6 P -","- C30 H38 O12 P2 -","2","1","","Yu, Jipan; Zhao, Xiaona; Miao, Zhiwei; Chen, Ruyu","Highly diastereoselective vinylogous Mukaiyama aldol reaction of α-keto phosphonates with 2-(trimethylsilyloxy)furan catalyzed by Cu(OTf)(2).","Organic & biomolecular chemistry","2011","9","19","6721","6726","10.1039/c1ob05822c","","","0.71073","MoKα","","0.0462","0.0378","","","0.1005","0.1056","","","","","","1.028","","","","has coordinates","180305","2020-10-21","18:00:00",""
"7152000","9.859","0.002","17.767","0.004","12.361","0.003","90","","91.25","0.03","90","","2164.7","0.8","293","2","293","2","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C43 H44 N4 Ni O6 S -","- C43.5 H43.5 N4 Ni O6.25 S -","- C87 H87 N8 Ni2 O12.5 S2 -","2","1","","Song, Guowei; Jin, Meihong; Li, Zhenjiang; Ouyang, Pingkai","Asymmetric synthesis of α,β-diamino acid derivates via Mannich-type reactions of a chiral Ni(ii) complex of glycine with N-tosyl imines.","Organic & biomolecular chemistry","2011","9","20","7144","7150","10.1039/c1ob05848g","","","0.71073","MoKα","","0.1003","0.0678","","","0.1661","0.1919","","","","","","1.065","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152001","6.09459","0.00014","7.56496","0.00017","33.7307","0.0008","84.8926","0.0019","87.4794","0.0019","88.9974","0.0018","1547.35","0.06","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H23 F17 Ge -","- C31.997 H23 F16.991 Ge -","- C63.994 H46 F33.982 Ge2 -","2","1","","Carr, James L.; Sejberg, Jimmy J. P.; Saab, Fabienne; Holdom, Mary D.; Davies, Anna M.; White, Andrew J. P.; Leatherbarrow, Robin J.; Beavil, Andrew J.; Sutton, Brian J.; Lindell, Stephen D.; Spivey, Alan C.","Synthesis of the C19 methyl ether of aspercyclide A via germyl-Stille macrocyclisation and ELISA evaluation of both enantiomers following optical resolution.","Organic & biomolecular chemistry","2011","9","19","6814","6824","10.1039/c1ob05862b","","","1.54184","CuKα","","0.0609","0.0517","","","0.1368","0.1415","","","","","","1.047","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152002","5.8122","0.0004","17.1465","0.0014","36.266","0.003","90","","93.295","0.001","90","","3608.3","0.5","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C38 H40 O4 S6 -","- C18.6305 H19.6305 O2 S2.8695 -","- C149.044 H157.044 O16 S22.956 -","8","2","","Das, Soumyajit; Bedi, Anjan; Krishna, G. Rama; Reddy, C. Malla; Zade, Sanjio S.","Cyclopenta[c]selenophene based cooligomers and their polymers: comparative study with thiophene analogues.","Organic & biomolecular chemistry","2011","9","20","6963","6972","10.1039/c1ob05866e","","","0.71073","MoKα","","0.1638","0.1515","","","0.4817","0.5028","","","","","","2.401","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152003","5.7974","0.0007","17.042","0.002","41.927","0.005","90","","90.92","0.005","90","","4141.8","0.9","296","2","296","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C19 H18 Br2 O2 S2 Se -","- C19 H18 Br2 O2 S2 Se -","- C152 H144 Br16 O16 S16 Se8 -","8","2","","Das, Soumyajit; Bedi, Anjan; Krishna, G. Rama; Reddy, C. Malla; Zade, Sanjio S.","Cyclopenta[c]selenophene based cooligomers and their polymers: comparative study with thiophene analogues.","Organic & biomolecular chemistry","2011","9","20","6963","6972","10.1039/c1ob05866e","","","0.71073","MoKα","","0.0983","0.0467","","","0.124","0.1575","","","","","","0.937","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152004","16.814","0.004","13.493","0.003","8.7591","0.0018","90","","100.732","0.005","90","","1952.4","0.8","153","2","153","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C25 H18 N2 O5 -","- C25 H18 N2 O5 -","- C100 H72 N8 O20 -","4","1","","Kudale, Amit A.; Miller, David O.; Dawe, Louise N.; Bodwell, Graham J.","Intramolecular Povarov reactions involving 3-aminocoumarins.","Organic & biomolecular chemistry","2011","9","20","7196","7206","10.1039/c1ob05867c","","","0.7107","MoKα","","0.1154","0.0992","","","0.1784","0.1859","","","","","","1.305","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152005","16.4686","0.0019","16.933","0.0019","36.391","0.004","90","","90","","90","","10148","2","","","","","","","","","","","","4","C 2 2 21","C 2c 2","20","","","","- C51 H62 Br2 O10 -","- C51 H62 Br2 O10 -","- C408 H496 Br16 O80 -","8","1","","Liu, Luzhi; Cao, Derong; Jin, Yi; Tao, Hongqi; Kou, Yuhui; Meier, Herbert","Efficient synthesis of copillar[5]arenes and their host-guest properties with dibromoalkanes.","Organic & biomolecular chemistry","2011","9","20","7007","7010","10.1039/c1ob05871a","","","","","","0.094","","","","","","","","","","","","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7152006","7.6651","0.0006","13.1131","0.0009","29.874","0.002","90","","90","","90","","3002.7","0.4","298","2","298","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C28 H34 N2 O12 -","- C28 H34 N2 O12 -","- C112 H136 N8 O48 -","4","0.5","","Wang, Liang; Xia, Xu-Dong; Guo, Wei; Chen, Jia-Rong; Xiao, Wen-Jing","Palladium-catalyzed C-H acetoxylation of 2-methoxyimino-2-aryl-acetates and acetamides.","Organic & biomolecular chemistry","2011","9","20","6895","6898","10.1039/c1ob05887h","","","0.71073","MoKα","","0.0485","0.0418","","","0.1173","0.1216","","","","","","1.054","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152007","9.636","0.002","9.93","0.002","14.63","0.003","88.48","0.002","85.747","0.002","80.272","0.002","1375.8","0.5","273","2","273","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H16 N4 -","- C16 H16 N4 -","- C64 H64 N16 -","4","2","","Yu, Xingxin; Yang, Qin; Lou, Honglei; Peng, Yiyuan; Wu, Jie","An efficient approach to pyrazolo[5,1-a]isoquinolin-2-amines via a silver(i)-catalyzed three-component reaction of 2-alkynylbenzaldehyde, sulfonohydrazide, and nitrile.","Organic & biomolecular chemistry","2011","9","20","7033","7037","10.1039/c1ob05917c","","","0.71073","MoKα","","0.0581","0.0507","","","0.1335","0.1436","","","","","","1.071","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152008","8.4105","0.0017","5.6321","0.0011","10.022","0.002","90","","107.78","0.003","90","","452.05","0.16","293","2","293","2","","","","","","","synthesis as described","4","P 1 21 1","P 2yb","4","","","","- C10 H11 N O2 -","- C10 H11 N O2 -","- C20 H22 N2 O4 -","2","1","","Devi, Rema B.; Henrot, Matthias; De Paolis, Michaël; Maddaluno, Jacques","Domino alkylation/oxa-Michael of 1,3-cyclohexanediones: Steering the C/O-chemoselectivity to reach tetrahydrobenzofuranones.","Organic & biomolecular chemistry","2011","9","19","6509","6512","10.1039/c1ob05923h","","x-ray","0.71073","MoKα","","0.0366","0.0354","","","0.0966","0.098","","","","","","1.061","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152009","24.215","0.004","14.85","0.002","16.053","0.002","90","","124.684","0.003","90","","4746.8","1.2","93","2","93","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H22 Cl2 Co N6 O2 -","- C24 H18 Cl2 Co N6 O2 -","- C192 H144 Cl16 Co8 N48 O16 -","8","1","","Das, Sudipta; Guha, Subarna; Banerjee, Arnab; Lohar, Sisir; Sahana, Animesh; Das, Debasis","2-(2-Pyridyl) benzimidazole based Co(ii) complex as an efficient fluorescent probe for trace level determination of aspartic and glutamic acid in aqueous solution: A displacement approach.","Organic & biomolecular chemistry","2011","9","20","7097","7104","10.1039/c1ob05951c","","","0.71073","MoKα","","0.0862","0.0539","","","0.1435","0.1613","","","","","","1.044","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152010","18.004","0.003","39.249","0.006","8.1408","0.0011","90","","90","","90","","5752.6","1.5","123","","123","","","","","","","","","4","F d d 2","F 2 -2d","43","","","","- C18 H15 N O3 -","- C18 H15 N O3 -","- C288 H240 N16 O48 -","16","1","","Genady, Afaf R.; Nakamura, Hiroyuki","Amphiphilic allylation of arylidene-1,3-oxazol-5(4H)-one using bis-π-allylpalladium complexes: an approach to synthesis of cyclohexyl and cyclohexenyl α-amino acids.","Organic & biomolecular chemistry","2011","9","20","7180","7189","10.1039/c1ob05952a","","","0.71073","MoKα","","0.0476","0.0391","","","0.0546","0.0557","","","","","","1.675","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152011","10.6098","0.0013","18.036","0.002","9.5122","0.0012","90","","98.751","0.001","90","","1799","0.4","123","","123","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C22 H21 N O3 -","- C21 H21 N O3 -","- C84 H84 N4 O12 -","4","1","","Genady, Afaf R.; Nakamura, Hiroyuki","Amphiphilic allylation of arylidene-1,3-oxazol-5(4H)-one using bis-π-allylpalladium complexes: an approach to synthesis of cyclohexyl and cyclohexenyl α-amino acids.","Organic & biomolecular chemistry","2011","9","20","7180","7189","10.1039/c1ob05952a","","","0.71073","MoKα","","0.0495","0.0403","","","0.0985","0.1039","","","","","","1.027","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152012","29.149","0.006","7.5081","0.0015","15.387","0.003","90","","107.3","0.002","90","","3215.2","1.1","123","","123","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C160 H152 N8 O24 -","8","1","","Genady, Afaf R.; Nakamura, Hiroyuki","Amphiphilic allylation of arylidene-1,3-oxazol-5(4H)-one using bis-π-allylpalladium complexes: an approach to synthesis of cyclohexyl and cyclohexenyl α-amino acids.","Organic & biomolecular chemistry","2011","9","20","7180","7189","10.1039/c1ob05952a","","","0.71073","MoKα","","0.0693","0.0448","","","0.0954","0.1059","","","","","","1.03","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152013","5.1207","0.0004","18.0019","0.0011","5.8831","0.0005","90","","109.066","0.008","90","","512.57","0.07","185","2","185","2","","","","","","","","5","P 1 21 1","P 2yb","4","","(S)-tert-butyl (2-oxothietan-3-yl)carbamate","","- C8 H13 N O3 S -","- C8 H13 N O3 S -","- C16 H26 N2 O6 S2 -","2","1","","Aubry, Sylvain; Sasaki, Kaname; Eloy, Laure; Aubert, Geneviève; Retailleau, Pascal; Cresteil, Thierry; Crich, David","Exploring the potential of the β-thiolactones in bioorganic chemistry.","Organic & biomolecular chemistry","2011","9","20","7134","7143","10.1039/c1ob05967j","","","1.54187","CuKα","","0.0719","0.0539","","","0.126","0.1749","","","","","","1.169","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152014","5.48411","0.00017","8.0007","0.0002","41.2338","0.0012","90","","90.353","0.003","90","","1809.17","0.09","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C17 H25 N3 O2 S -","- C17 H25 N3 O2 S -","- C68 H100 N12 O8 S4 -","4","1","","Craig, Donald; Harvey, John W.; O'Brien, Alexander G; White, Andrew J. P.","Claisen rearrangements of equilibrating allylic azides.","Organic & biomolecular chemistry","2011","9","20","7057","7061","10.1039/c1ob05972f","","","0.71073","MoKα","","0.1493","0.1083","","","0.1913","0.2018","","","","","","1.212","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152015","13.7746","0.0009","11.7176","0.0008","19.9018","0.0012","90","","127.838","0.004","90","","2536.9","0.3","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H37 N O6 -","- C26 H37 N O6 -","- C104 H148 N4 O24 -","4","1","","Fichtler, Robert; Neudörfl, Jörg-M; Jacobi von Wangelin, Axel","Practical three-component synthesis of crowded arenes with donor-acceptor substitution.","Organic & biomolecular chemistry","2011","9","20","7224","7236","10.1039/c1ob05984j","","","0.71073","MoKα","","0.1128","0.0434","","","0.0731","0.0843","","","","","","0.853","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152016","10.4445","0.001","14.899","0.002","16.596","0.002","90","","90","","90","","2582.5","0.5","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C26 H37 N O6 -","- C26 H37 N O6 -","- C104 H148 N4 O24 -","4","1","","Fichtler, Robert; Neudörfl, Jörg-M; Jacobi von Wangelin, Axel","Practical three-component synthesis of crowded arenes with donor-acceptor substitution.","Organic & biomolecular chemistry","2011","9","20","7224","7236","10.1039/c1ob05984j","","","0.71073","MoKα","","0.1486","0.0554","","","0.1058","0.1299","","","","","","0.909","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152017","8.3411","0.0013","17.2794","0.0017","12.2343","0.0019","90","","98.713","0.005","90","","1743","0.4","100","2","100","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H25 N O5 -","- C18 H25 N O5 -","- C72 H100 N4 O20 -","4","1","","Fichtler, Robert; Neudörfl, Jörg-M; Jacobi von Wangelin, Axel","Practical three-component synthesis of crowded arenes with donor-acceptor substitution.","Organic & biomolecular chemistry","2011","9","20","7224","7236","10.1039/c1ob05984j","","","0.71073","MoKα","","0.1036","0.0456","","","0.0945","0.1098","","","","","","0.879","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152018","14.6003","0.0006","17.4066","0.0008","9.8449","0.0003","90","","115.519","0.002","90","","2257.91","0.16","100","2","100","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C26 H25 N O5 -","- C26 H25 N O5 -","- C104 H100 N4 O20 -","4","1","","Fichtler, Robert; Neudörfl, Jörg-M; Jacobi von Wangelin, Axel","Practical three-component synthesis of crowded arenes with donor-acceptor substitution.","Organic & biomolecular chemistry","2011","9","20","7224","7236","10.1039/c1ob05984j","","","0.71073","MoKα","","0.045","0.0334","","","0.0713","0.0749","","","","","","1.045","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152019","10.9806","0.0006","8.1088","0.0004","26.2218","0.0015","90","","90","","90","","2334.8","0.2","100","2","100","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C12 H16 N2 O3 -","- C12 H16 N2 O3 -","- C96 H128 N16 O24 -","8","1","","Fichtler, Robert; Neudörfl, Jörg-M; Jacobi von Wangelin, Axel","Practical three-component synthesis of crowded arenes with donor-acceptor substitution.","Organic & biomolecular chemistry","2011","9","20","7224","7236","10.1039/c1ob05984j","","","0.71073","MoKα","","0.09","0.0412","","","0.0945","0.1257","","","","","","1.009","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152020","7.9089","0.0007","9.6396","0.0009","10.547","0.008","90.566","0.005","97.78","0.005","97.777","0.004","789","0.6","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C17 H24 N2 O3 -","- C17 H24 N2 O3 -","- C34 H48 N4 O6 -","2","1","","Fichtler, Robert; Neudörfl, Jörg-M; Jacobi von Wangelin, Axel","Practical three-component synthesis of crowded arenes with donor-acceptor substitution.","Organic & biomolecular chemistry","2011","9","20","7224","7236","10.1039/c1ob05984j","","","0.71073","MoKα","","0.0923","0.0514","","","0.1151","0.129","","","","","","1.06","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152021","10.8021","0.0012","10.5357","0.0007","13.5435","0.0012","90","","124.2","0.006","90","","1274.8","0.2","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H15 Br N2 O3 -","- C12 H15 Br N2 O3 -","- C48 H60 Br4 N8 O12 -","4","1","","Fichtler, Robert; Neudörfl, Jörg-M; Jacobi von Wangelin, Axel","Practical three-component synthesis of crowded arenes with donor-acceptor substitution.","Organic & biomolecular chemistry","2011","9","20","7224","7236","10.1039/c1ob05984j","","","0.71073","MoKα","","0.0608","0.0372","","","0.0777","0.084","","","","","","1.012","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152022","11.9261","0.0005","17.9405","0.0014","15.2365","0.0011","90","","96.061","0.004","90","","3241.8","0.4","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C16 H20 N2 O3 -","- C16 H20 N2 O3 -","- C128 H160 N16 O24 -","8","2","","Fichtler, Robert; Neudörfl, Jörg-M; Jacobi von Wangelin, Axel","Practical three-component synthesis of crowded arenes with donor-acceptor substitution.","Organic & biomolecular chemistry","2011","9","20","7224","7236","10.1039/c1ob05984j","","","0.71073","MoKα","","0.116","0.0504","","","0.0984","0.1154","","","","","","0.92","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152023","10.0665","0.0017","8.4236","0.0014","12.792","0.002","90","","96.133","0.003","90","","1078.5","0.3","133","2","133","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C21 H29 N O3 S2 -","- C21 H29 N O3 S2 -","- C42 H58 N2 O6 S4 -","2","1","","Zhang, Hua; Li, Ya; Xu, Wei; Zheng, Wenrui; Zhou, Pei; Sun, Zhihua","Practical and stereoselective synthesis of β-amino sulfones from alkyl phenyl sulfones and N-(tert-butylsulfinyl) aldimines.","Organic & biomolecular chemistry","2011","9","19","6502","6505","10.1039/c1ob05992k","","","0.71073","MoKα","","0.0295","0.028","","","0.0722","0.0735","","","","","","1.045","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152024","9.3107","0.0007","9.3161","0.0007","11.1998","0.0011","92.711","0.004","114.378","0.003","100.866","0.003","860.44","0.13","150","2","150","2","","","","","","","","3","P -1","-P 1","2","5-phenyldihydroazulene","","","- C24 H16 N2 -","- C24 H16 N2 -","- C48 H32 N4 -","2","1","","Skov, Louise; Petersen, Michael Åxman; Broman, Søren Lindbæk; Bond, Andrew D.; Nielsen, Mogens Brøndsted","New synthetic route to substituted dihydroazulene photoswitches.","Organic & biomolecular chemistry","2011","9","19","6498","6501","10.1039/c1ob06059g","","","0.71073","MoKα","","0.0444","0.0349","","","0.0852","0.0907","","","","","","1.032","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152025","8.494","0.002","11.25","0.003","14.974","0.004","90","","93.01","0.004","90","","1428.9","0.6","446","2","446","2","","","","","","","","6","P 1 21 1","P 2yb","4","","(R)-(diphenylphosphoryl)((S)-1-(quinolin-8-ylsulfonyl)pyrrolidin-2-yl)methanol","","- C30 H33 N2 O6 P S -","- C30 H33 N2 O6 P S -","- C60 H66 N4 O12 P2 S2 -","2","1","","Zeng, Zhiping; Luo, Ping; Jiang, Yao; Liu, Yan; Tang, Guo; Xu, Pengxiang; Zhao, Yufen; Blackburn, G. Michael","Chiral phosphoproline-catalyzed asymmetric Michael addition of ketones to nitroolefins: an experimental and theoretical study.","Organic & biomolecular chemistry","2011","9","20","6973","6978","10.1039/c1ob06143g","","","0.71073","MoKα","","0.0522","0.0485","","","0.1243","0.1265","","","","","","1.037","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152026","10.2884","0.0003","13.649","0.0003","18.6062","0.0005","110.437","0.002","95.594","0.002","91.674","0.002","2431.07","0.12","273","2","273","2","","","","","","","","4","P -1","-P 1","2","","","","- C9 H15.5 N6 O2.75 -","- C9 H15.5 N6 O2.75 -","- C72 H124 N48 O22 -","8","4","","González-Jiménez, Mario; Arenas-Valgañón, Jorge; Calle, Emilio; Casado, Julio","Aromatic C-nitrosation of a bioactive molecule. Nitrosation of minoxidil.","Organic & biomolecular chemistry","2011","9","22","7680","7684","10.1039/c1ob05686g","","","1.54178","CuKα","","0.0463","0.0414","","","0.1096","0.1164","","","","","","1.037","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152027","30.3355","0.0008","7.26159","0.00018","18.3813","0.0005","90","","100.442","0.002","90","","3982.05","0.18","100","","100","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C19 H18 Cl2 Fe O7 -","- C19 H18 Cl2 Fe O7 -","- C152 H144 Cl16 Fe8 O56 -","8","1","","Lee, Do W.; Pandey, Rajesh K.; Lindeman, Sergey; Donaldson, William A.","Reactivity of acyclic (pentadienyl)iron(1+) cations: Synthetic studies directed toward the frondosins.","Organic & biomolecular chemistry","2011","9","22","7742","7747","10.1039/c1ob05720k","","","0.7107","MoKα","","0.0281","0.0233","","","0.0618","0.063","","","","","","1.068","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152028","10.1269","0.0004","10.2163","0.0003","12.6671","0.0003","100.953","0.002","106.792","0.003","110.272","0.003","1113.84","0.07","100.2","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H26 Fe O7 -","- C24 H26 Fe O7 -","- C48 H52 Fe2 O14 -","2","1","","Lee, Do W.; Pandey, Rajesh K.; Lindeman, Sergey; Donaldson, William A.","Reactivity of acyclic (pentadienyl)iron(1+) cations: Synthetic studies directed toward the frondosins.","Organic & biomolecular chemistry","2011","9","22","7742","7747","10.1039/c1ob05720k","","","0.7107","MoKα","","0.0386","0.031","","","0.0685","0.0723","","","","","","1.063","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152029","9.7069","0.0002","13.1541","0.0003","16.1134","0.0004","90","","91.268","0.001","90","","2056.94","0.08","100","2","100","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H22 Fe O7 -","- C21 H22 Fe O7 -","- C84 H88 Fe4 O28 -","4","1","","Lee, Do W.; Pandey, Rajesh K.; Lindeman, Sergey; Donaldson, William A.","Reactivity of acyclic (pentadienyl)iron(1+) cations: Synthetic studies directed toward the frondosins.","Organic & biomolecular chemistry","2011","9","22","7742","7747","10.1039/c1ob05720k","","","1.54178","CuKα","","0.0293","0.0261","","","0.0663","0.0678","","","","","","0.986","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152030","10.2155","0.0004","10.6315","0.0004","13.011","0.0005","102.007","0.003","106.062","0.003","110.218","0.003","1199.83","0.09","100.1","","100","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H30 Fe O7 -","- C26 H30 Fe O7 -","- C52 H60 Fe2 O14 -","2","1","","Lee, Do W.; Pandey, Rajesh K.; Lindeman, Sergey; Donaldson, William A.","Reactivity of acyclic (pentadienyl)iron(1+) cations: Synthetic studies directed toward the frondosins.","Organic & biomolecular chemistry","2011","9","22","7742","7747","10.1039/c1ob05720k","","","0.7107","MoKα","","0.0576","0.045","","","0.1062","0.1155","","","","","","1.057","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152031","6.94866","0.00009","15.94213","0.00019","36.7435","0.0005","90","","93.4868","0.0012","90","","4062.78","0.09","100","","100","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C21 H22 Fe O7 -","- C21 H22 Fe O7 -","- C168 H176 Fe8 O56 -","8","2","","Lee, Do W.; Pandey, Rajesh K.; Lindeman, Sergey; Donaldson, William A.","Reactivity of acyclic (pentadienyl)iron(1+) cations: Synthetic studies directed toward the frondosins.","Organic & biomolecular chemistry","2011","9","22","7742","7747","10.1039/c1ob05720k","","","0.7107","MoKα","","0.0476","0.0364","","","0.0869","0.089","","","","","","1.141","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152032","7.525","0.003","10.852","0.004","11.633","0.004","103.951","0.006","105.568","0.007","99.03","0.006","862.8","0.6","294","2","294","2","","","","","","","","4","P -1","-P 1","2","racemic cyclo(2-hydroxy-2-((3,4,5- trimethyloxy)phenylmethyl)glycyl-prolyl","racemic cyclo[2-hydroxy-2-[(3,4,5-trimethyloxy)phenylmethyl]glycyl-prolyl","","- C17 H22 N2 O6 -","- C17 H22 N2 O6 -","- C34 H44 N4 O12 -","2","1","","Liu, Shouxin; Mu, Yun; Han, Jianrong; Zhen, Xiaoli; Yang, Yihua; Tian, Xia; Whiting, Andrew","Stereoselective synthesis and rearrangement-fragmentation of arylidene N-alkoxydiketopiperazines.","Organic & biomolecular chemistry","2011","9","21","7476","7481","10.1039/c1ob05722g","","","0.71073","MoKα","","0.1443","0.0579","","","0.1453","0.1914","","","","","","1.057","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152033","9.7941","0.0014","10.3009","0.0015","17.223","0.002","90","","90","","90","","1737.6","0.4","294","2","294","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(S)-cyclo(N-cyclohexyloxy-2-((beta-pyridyl) methylene)glycyl- prolyl","(S)-cyclo[N-cyclohexyloxy-2-[(β-pyridyl) methylene]glycyl-prolyl","","- C19 H23 N3 O3 -","- C19 H23 N3 O3 -","- C76 H92 N12 O12 -","4","1","","Liu, Shouxin; Mu, Yun; Han, Jianrong; Zhen, Xiaoli; Yang, Yihua; Tian, Xia; Whiting, Andrew","Stereoselective synthesis and rearrangement-fragmentation of arylidene N-alkoxydiketopiperazines.","Organic & biomolecular chemistry","2011","9","21","7476","7481","10.1039/c1ob05722g","","","0.71073","MoKα","","0.0458","0.0321","","","0.0741","0.0829","","","","","","1.039","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152034","6.9814","0.0002","20.5732","0.0006","9.8023","0.0002","90","","105.643","0.001","90","","1355.75","0.06","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H16 N4 Se2 -","- C11 H16 N4 Se2 -","- C44 H64 N16 Se8 -","4","1","","Bhabak, Krishna P.; Satheeshkumar, Kandhan; Jayavelu, Subramaniam; Mugesh, Govindasamy","Inhibition of peroxynitrite- and peroxidase-mediated protein tyrosine nitration by imidazole-based thiourea and selenourea derivatives.","Organic & biomolecular chemistry","2011","9","21","7343","7350","10.1039/c1ob05773a","","","0.71073","MoKα","","0.0436","0.0293","","","0.0663","0.0872","","","","","","1.646","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152035","6.893","0.002","20.222","0.006","9.776","0.003","90","","106.617","0.005","90","","1305.8","0.7","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C11 H16 N4 S2 -","- C11 H16 N4 S2 -","- C44 H64 N16 S8 -","4","1","","Bhabak, Krishna P.; Satheeshkumar, Kandhan; Jayavelu, Subramaniam; Mugesh, Govindasamy","Inhibition of peroxynitrite- and peroxidase-mediated protein tyrosine nitration by imidazole-based thiourea and selenourea derivatives.","Organic & biomolecular chemistry","2011","9","21","7343","7350","10.1039/c1ob05773a","","","0.71073","MoKα","","0.0594","0.0407","","","0.1011","0.1131","","","","","","1.036","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152036","11.551","0.0006","8.8676","0.0004","14.669","0.0009","90","","107.566","0.003","90","","1432.48","0.13","291","2","291","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12 H18 N4 Se2 -","- C12 H18 N4 Se2 -","- C48 H72 N16 Se8 -","4","0.5","","Bhabak, Krishna P.; Satheeshkumar, Kandhan; Jayavelu, Subramaniam; Mugesh, Govindasamy","Inhibition of peroxynitrite- and peroxidase-mediated protein tyrosine nitration by imidazole-based thiourea and selenourea derivatives.","Organic & biomolecular chemistry","2011","9","21","7343","7350","10.1039/c1ob05773a","","","0.71073","MoKα","","0.0576","0.0404","","","0.0982","0.11","","","","","","1.047","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152037","11.7252","0.0009","8.7848","0.0007","33.465","0.003","90","","90","","90","","3447","0.5","291","2","291","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C13 H20 N4 Se2 -","- C13 H20 N4 Se2 -","- C104 H160 N32 Se16 -","8","1","","Bhabak, Krishna P.; Satheeshkumar, Kandhan; Jayavelu, Subramaniam; Mugesh, Govindasamy","Inhibition of peroxynitrite- and peroxidase-mediated protein tyrosine nitration by imidazole-based thiourea and selenourea derivatives.","Organic & biomolecular chemistry","2011","9","21","7343","7350","10.1039/c1ob05773a","","","0.71073","MoKα","","0.1313","0.0601","","","0.127","0.1419","","","","","","0.837","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152038","16.89","0.04","15.29","0.04","16.64","0.04","90","","110.63","0.03","90","","4022","17","100","2","100","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C44 H45 Cl4 N7 O2 -","- C44 H45 Cl4 N7 O2 -","- C176 H180 Cl16 N28 O8 -","4","1","","Kolesnikov, Grigory V.; German, Konstantin E.; Kirakosyan, Gayane; Tananaev, Ivan G.; Ustynyuk, Yuri A.; Khrustalev, Victor N.; Katayev, Evgeny A.","Macrocyclic receptor for pertechnetate and perrhenate anions.","Organic & biomolecular chemistry","2011","9","21","7358","7364","10.1039/c1ob05873h","","","0.71073","MoKα","","0.3707","0.0906","","","0.1391","0.2213","","","","","","0.876","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152039","27.4384","0.001","5.6289","0.0002","22.7063","0.0008","90","","112.241","0.003","90","","3246","0.2","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C17 H16 Cl2 O6 -","- C17 H16 Cl2 O6 -","- C136 H128 Cl16 O48 -","8","1","","Iaroshenko, Viktor O.; Bunescu, Alina; Spannenberg, Anke; Supe, Linda; Milyutina, Maria; Langer, Peter","3-Methoxalylchromones - versatile reagents for the regioselective synthesis of functionalized 2,4'-dihydroxybenzophenones, potential UV-filters.","Organic & biomolecular chemistry","2011","9","21","7554","7558","10.1039/c1ob05931a","","","0.71073","MoKα","","0.0339","0.0264","","","0.0702","0.0719","","","","","","1.016","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152040","8.2989","0.0006","10.1312","0.0007","10.4773","0.0007","86.56","0.005","83.809","0.005","70.127","0.005","823.36","0.1","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C18 H18 O8 -","- C18 H18 O8 -","- C36 H36 O16 -","2","1","","Iaroshenko, Viktor O.; Bunescu, Alina; Spannenberg, Anke; Supe, Linda; Milyutina, Maria; Langer, Peter","3-Methoxalylchromones - versatile reagents for the regioselective synthesis of functionalized 2,4'-dihydroxybenzophenones, potential UV-filters.","Organic & biomolecular chemistry","2011","9","21","7554","7558","10.1039/c1ob05931a","","","0.71073","MoKα","","0.0497","0.0365","","","0.0938","0.0971","","","","","","1.065","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152041","10.152","0.002","8.2423","0.0016","12.511","0.003","90","","99.49","0.03","90","","1032.5","0.4","150","2","150","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H22 O7 -","- C25 H22 O7 -","- C50 H44 O14 -","2","1","","Iaroshenko, Viktor O.; Bunescu, Alina; Spannenberg, Anke; Supe, Linda; Milyutina, Maria; Langer, Peter","3-Methoxalylchromones - versatile reagents for the regioselective synthesis of functionalized 2,4'-dihydroxybenzophenones, potential UV-filters.","Organic & biomolecular chemistry","2011","9","21","7554","7558","10.1039/c1ob05931a","","","0.71073","MoKα","","0.0315","0.0276","","","0.0677","0.0688","","","","","","0.983","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152042","7.9176","0.0004","11.1261","0.0006","11.5814","0.0007","89.052","0.005","80.895","0.004","77.206","0.004","982.18","0.1","150","2","150","2","","","","","","","","3","P -1","-P 1","2","","","","- C23 H20 O8 -","- C23 H20 O8 -","- C46 H40 O16 -","2","1","","Iaroshenko, Viktor O.; Bunescu, Alina; Spannenberg, Anke; Supe, Linda; Milyutina, Maria; Langer, Peter","3-Methoxalylchromones - versatile reagents for the regioselective synthesis of functionalized 2,4'-dihydroxybenzophenones, potential UV-filters.","Organic & biomolecular chemistry","2011","9","21","7554","7558","10.1039/c1ob05931a","","","0.71073","MoKα","","0.0527","0.0326","","","0.0741","0.0773","","","","","","0.85","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152043","9.7224","0.0003","8.1879","0.0002","23.1457","0.0008","90","","95.519","0.003","90","","1834","0.1","150","2","150","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C20 H19 Cl O7 -","- C20 H19 Cl O7 -","- C80 H76 Cl4 O28 -","4","1","","Iaroshenko, Viktor O.; Bunescu, Alina; Spannenberg, Anke; Supe, Linda; Milyutina, Maria; Langer, Peter","3-Methoxalylchromones - versatile reagents for the regioselective synthesis of functionalized 2,4'-dihydroxybenzophenones, potential UV-filters.","Organic & biomolecular chemistry","2011","9","21","7554","7558","10.1039/c1ob05931a","","","0.71073","MoKα","","0.0446","0.0303","","","0.072","0.0743","","","","","","0.968","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152044","9.0595","0.0004","11.5721","0.0005","15.5179","0.0006","73.732","0.003","84.917","0.003","87.568","0.003","1555.32","0.12","150","2","150","2","","","","","","","","4","P -1","-P 1","2","","","","- C33 H45 Br O7 -","- C33 H45 Br O7 -","- C66 H90 Br2 O14 -","2","1","","Iaroshenko, Viktor O.; Bunescu, Alina; Spannenberg, Anke; Supe, Linda; Milyutina, Maria; Langer, Peter","3-Methoxalylchromones - versatile reagents for the regioselective synthesis of functionalized 2,4'-dihydroxybenzophenones, potential UV-filters.","Organic & biomolecular chemistry","2011","9","21","7554","7558","10.1039/c1ob05931a","","","0.71073","MoKα","","0.058","0.0343","","","0.0633","0.0669","","","","","","0.874","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152045","8.023","","15.891","","22.67","","90","","97.96","","90","","2862.43","","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C18 H13 F N2 O -","- C18 H13 F N2 O -","- C144 H104 F8 N16 O8 -","8","1","","Huang, Aiping; Liu, Feng; Zhan, Chunjing; Liu, Yanli; Ma, Chen","One-pot synthesis of pyrrolo[1,2-a]quinoxalines.","Organic & biomolecular chemistry","2011","9","21","7351","7357","10.1039/c1ob05936j","","","0.71073","MoKα","","0.0772","0.0495","","","0.1248","0.1443","","","","","","1.018","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152046","9.032","0.002","9.319","0.002","9.925","0.002","88.946","0.002","73.298","0.002","65.822","0.002","725.2","0.3","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C19 H16 N2 O -","- C19 H16 N2 O -","- C38 H32 N4 O2 -","2","1","","Huang, Aiping; Liu, Feng; Zhan, Chunjing; Liu, Yanli; Ma, Chen","One-pot synthesis of pyrrolo[1,2-a]quinoxalines.","Organic & biomolecular chemistry","2011","9","21","7351","7357","10.1039/c1ob05936j","","","0.71073","MoKα","","0.0787","0.0563","","","0.1758","0.2001","","","","","","0.96","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152047","7.5097","0.0005","14.8345","0.001","27.016","0.002","90","","90","","90","","3009.7","0.4","200","2","200","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","(E)-1-((E)-3-(4-nitrophenyl)allylidene)- 3,4-dihydronaphthalen-2(1H)-one","","- C19 H15 N O3 -","- C19 H15 N O3 -","- C152 H120 N8 O24 -","8","1","","Chen, Jung-Hsuan; Chang, Chihliang; Chang, Hui-Ju; Chen, Kwunmin","Synthesis of 2,3,5,6-tetrahydro-1-alkyl/aryl-1H-benzo[f]chromen-3-ol derivatives from β-tetralones and α,β-unsaturated aldehydes.","Organic & biomolecular chemistry","2011","9","21","7510","7516","10.1039/c1ob05966a","","","0.71073","MoKα","","0.0633","0.0412","","","0.0956","0.1065","","","","","","1.024","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152048","5.935","0.0001","14.0588","0.0003","17.2947","0.0005","90","","90","","90","","1443.05","0.06","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","1-phenyl-5,6-dihydro-1H-benzo[f]chromen -3(2H)-one","","- C19 H16 O2 -","- C19 H16 O2 -","- C76 H64 O8 -","4","1","","Chen, Jung-Hsuan; Chang, Chihliang; Chang, Hui-Ju; Chen, Kwunmin","Synthesis of 2,3,5,6-tetrahydro-1-alkyl/aryl-1H-benzo[f]chromen-3-ol derivatives from β-tetralones and α,β-unsaturated aldehydes.","Organic & biomolecular chemistry","2011","9","21","7510","7516","10.1039/c1ob05966a","","","0.71073","MoKα","","0.0745","0.0446","","","0.1014","0.1232","","","","","","1.155","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152049","8.096","0.001","8.215","0.001","18.205","0.002","84.374","0.006","81.515","0.005","79.197","0.005","1173.2","0.2","100","2","100","2","","","","","","","","5","P -1","-P 1","2","","","","- C24 H22 Cu N6 O8 -","- C24 H22 Cu N6 O8 -","- C48 H44 Cu2 N12 O16 -","2","1","","Roy, Basab; Rao, Alla Sreenivasa; Ahn, Kyo Han","Mononuclear Zn(ii)- and Cu(ii)-complexes of a hydroxynaphthalene-derived dipicolylamine: fluorescent sensing behaviours toward pyrophosphate ions.","Organic & biomolecular chemistry","2011","9","22","7774","7779","10.1039/c1ob05999h","","","0.71073","MoKα","","0.0429","0.0332","","","0.0825","0.0862","","","","","","1.035","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152050","10.6578","0.0002","32.0622","0.0006","12.1186","0.0003","90","","100.604","0.001","90","","4070.36","0.15","193","2","193","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","","","- C41 H41 B Cl2 F6 N6 O2 -","- C41 H41 B Cl2 F6 N6 O2 -","- C164 H164 B4 Cl8 F24 N24 O8 -","4","1","","Maether, Marie-Pierre; Bernat, Virginie; Maturano, Marie; André-Barrès, Christiane; Ladeira, Sonia; Valentin, Alexis; Vial, Henri; Payrastre, Corinne","Synthesis and antiplasmodial activity of streptocyanine/peroxide and streptocyanine/4-aminoquinoline hybrid dyes.","Organic & biomolecular chemistry","2011","9","21","7400","7410","10.1039/c1ob06048a","","x-ray","0.71073","MoKα","","0.082","0.0526","","","0.1367","0.1581","","","","","","1.038","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152051","17.3524","0.0003","11.5299","0.0002","18.2276","0.0003","90","","112.482","0.001","90","","3369.66","0.1","193","2","193","2","","","","","","","synthesis as described","7","P 1 21/c 1","-P 2ybc","14","","","","- C34 H34 B Cl F6 N4 O0.5 -","- C34 H34 B Cl F6 N4 O0.5 -","- C136 H136 B4 Cl4 F24 N16 O2 -","4","1","","Maether, Marie-Pierre; Bernat, Virginie; Maturano, Marie; André-Barrès, Christiane; Ladeira, Sonia; Valentin, Alexis; Vial, Henri; Payrastre, Corinne","Synthesis and antiplasmodial activity of streptocyanine/peroxide and streptocyanine/4-aminoquinoline hybrid dyes.","Organic & biomolecular chemistry","2011","9","21","7400","7410","10.1039/c1ob06048a","","x-ray","0.71073","MoKα","","0.0914","0.0683","","","0.1917","0.2135","","","","","","1.056","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7152052","21.3858","0.0004","11.0501","0.0002","30.9188","0.0007","90","","108.77","0.001","90","","6918","0.2","100","2","100","2","","","","","","","synthesis as described","7","C 1 2/c 1","-C 2yc","15","","","","- C34.5 H36 B Cl F6 N4 O2.5 -","- C34.5 H36 B Cl F6 N4 O2.5 -","- C276 H288 B8 Cl8 F48 N32 O20 -","8","1","","Maether, Marie-Pierre; Bernat, Virginie; Maturano, Marie; André-Barrès, Christiane; Ladeira, Sonia; Valentin, Alexis; Vial, Henri; Payrastre, Corinne","Synthesis and antiplasmodial activity of streptocyanine/peroxide and streptocyanine/4-aminoquinoline hybrid dyes.","Organic & biomolecular chemistry","2011","9","21","7400","7410","10.1039/c1ob06048a","","x-ray","0.71073","MoKα","","0.1021","0.0532","","","0.1132","0.1333","","","","","","1.014","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7152053","21.528","0.01","8.433","0.004","17.211","0.008","90","","94.65","0.016","90","","3114","3","150","2","150","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1'-cyclopropyl-4-methyl-1H,1'H-spiro[pyridine-2,2'- pyrido[2,3-d]pyrimidine]-3,4',6(3'H)-trione","","- C16.5 H17 N4 O3.5 -","- C16.5 H17 N4 O3.5 -","- C132 H136 N32 O28 -","8","1","","Antunes, Alexandra M. M.; Novais, David A.; Ferreira da Silva, J. L.; Santos, Pedro P.; Conceição Oliveira, M; Beland, Frederick A.; Matilde Marques, M.","Synthesis and oxidation of 2-hydroxynevirapine, a metabolite of the HIV reverse transcriptase inhibitor nevirapine.","Organic & biomolecular chemistry","2011","9","22","7822","7835","10.1039/c1ob06052j","","","0.71073","MoKα","","0.1389","0.0591","","","0.1096","0.1384","","","","","","0.954","","","","has coordinates","212870","2020-10-21","18:00:00",""
"7152054","11.398","0.005","12.638","0.005","20.547","0.011","107.151","0.012","96.768","0.012","103.674","0.008","2691","2","296","2","296","2","","","","","","","","2","P -1","-P 1","2","","","","- C39 H26 -","- C39 H26 -","- C156 H104 -","4","2","","Wang, Xiang-Chuan; Hu, Jie; Sun, Peng-Shuai; Zhong, Mei-Jin; Ali, Shaukat; Liang, Yong-Min","Copper-catalyzed dimerization fragmentation cyclization reactions of (E)-1-en-4-yn-3-ols as a versatile approach for the synthesis of multisubstituted 1H-cyclopenta[b]naphthalenes.","Organic & biomolecular chemistry","2011","9","21","7461","7467","10.1039/c1ob06087b","","","0.71073","MoKα","","0.1886","0.1369","","","0.3978","0.4315","","","","","","1.052","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152055","8.1131","0.0017","10.109","0.002","25.357","0.006","90","","90","","90","","2079.7","0.8","100","1","100","1","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H32 N2 O5 -","- C20 H32 N2 O5 -","- C80 H128 N8 O20 -","4","1","","Aitken, David J.; Drouin, Ludovic; Goretta, Sarah; Guillot, Régis; Ollivier, Jean; Spiga, Marco","Stereoselective preparation of β,γ-methano-GABA derivatives.","Organic & biomolecular chemistry","2011","9","21","7517","7524","10.1039/c1ob06095c","","x-ray","0.71073","MoKα","","0.0758","0.0532","","","0.1137","0.1231","","","","","","1.088","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152056","7.9874","0.0003","11.8978","0.0005","12.6662","0.0006","70.213","0.002","73.984","0.002","81.497","0.002","1086.69","0.08","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C28 H24 N2 O2 -","- C28 H24 N2 O2 -","- C56 H48 N4 O4 -","2","1","","Dupeyre, Grégory; Lemoine, Pascale; Ainseba, Nabila; Michel, Sylvie; Cachet, Xavier","A one-pot synthesis of 7-phenylindolo[3,2-a]carbazoles from indoles and β-nitrostyrenes, via an unprecedented reaction sequence.","Organic & biomolecular chemistry","2011","9","22","7780","7790","10.1039/c1ob06108a","","","0.71073","MoKα","","0.0905","0.0545","","","0.1266","0.1519","","","","","","0.959","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152057","11.6427","0.0003","11.6427","0.0003","24.4087","0.0011","90","","90","","90","","3308.66","0.19","123","2","123","2","","","","","","","","4","P 41 21 2","P 4abw 2nw","92","10200","","","- C16 H19 Br O5 -","- C16 H19 Br O5 -","- C128 H152 Br8 O40 -","8","1","","Tello-Aburto, Rodolfo; Kalstabakken, Kyle A.; Volp, Kelly A.; Harned, Andrew M.","Regioselective and stereoselective cyclizations of cyclohexadienones tethered to active methylene groups.","Organic & biomolecular chemistry","2011","9","22","7849","7859","10.1039/c1ob06125a","","","0.71073","MoKα","","0.0288","0.0271","","","0.0741","0.0754","","","","","","1.022","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152058","10.5256","0.0002","12.1392","0.0002","20.3601","0.0003","90","","90","","90","","2601.46","0.08","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C25 H31 Br N2 O8 -","- C25 H31 Br N2 O8 -","- C100 H124 Br4 N8 O32 -","4","1","","Ramachary, Dhevalapally B.; Reddy, Y. Vijayendar; Banerjee, Atoshi; Banerjee, Sharmistha","Design, synthesis and biological evaluation of optically pure functionalized spiro[5,5]undecane-1,5,9-triones as HIV-1 inhibitors.","Organic & biomolecular chemistry","2011","9","21","7282","7286","10.1039/c1ob06133j","","","1.54184","CuKα","","0.0296","0.0295","","","0.079","0.0791","","","","","","1.111","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152059","7.6547","0.0009","10.415","0.0009","13.3157","0.0014","90","","90.1","","90","","1061.58","0.19","100","2","100","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C22 H25 Br N2 O6 -","- C22 H25 Br N2 O6 -","- C44 H50 Br2 N4 O12 -","2","1","","Ramachary, Dhevalapally B.; Reddy, Y. Vijayendar; Banerjee, Atoshi; Banerjee, Sharmistha","Design, synthesis and biological evaluation of optically pure functionalized spiro[5,5]undecane-1,5,9-triones as HIV-1 inhibitors.","Organic & biomolecular chemistry","2011","9","21","7282","7286","10.1039/c1ob06133j","","","1.54184","CuKα","","0.0753","0.0729","","","0.1686","0.1709","","","","","","1.02","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152060","7.1487","0.0008","13.2022","0.0014","28.639","0.003","90","","90","","90","","2702.9","0.5","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C28 H38 O8 -","- C28 H38 O8 -","- C112 H152 O32 -","4","1","","Wang, Jian-Rong; Liu, Hai-Li; Kurtán, Tibor; Mándi, Attila; Antus, Sándor; Li, Jia; Zhang, Hai-Yan; Guo, Yue-Wei","Protolimonoids and norlimonoids from the stem bark of Toona ciliata var. pubescens.","Organic & biomolecular chemistry","2011","9","22","7685","7696","10.1039/c1ob06150j","","","0.71073","MoKα","","0.0785","0.0415","","","0.0847","0.0941","","","","","","0.857","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152061","10.208","0.0008","15.3825","0.0012","17.7371","0.0014","90","","90","","90","","2785.2","0.4","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C31 H50 O4 -","- C31 H50 O4 -","- C124 H200 O16 -","4","1","","Wang, Jian-Rong; Liu, Hai-Li; Kurtán, Tibor; Mándi, Attila; Antus, Sándor; Li, Jia; Zhang, Hai-Yan; Guo, Yue-Wei","Protolimonoids and norlimonoids from the stem bark of Toona ciliata var. pubescens.","Organic & biomolecular chemistry","2011","9","22","7685","7696","10.1039/c1ob06150j","","","0.71073","MoKα","","0.0679","0.0574","","","0.1384","0.145","","","","","","1.015","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152062","10.3331","0.0003","10.8017","0.0003","18.4984","0.0005","90","0","102.951","0.045","90","0","2012.2","0.4","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H23 N3 O3 S -","- C20 H23 N3 O3 S -","- C80 H92 N12 O12 S4 -","4","2","","Karabuga, Semistan; Cakici, Murat; Kazaz, Cavit; Sahin, Ertan; Kilic, Hamdullah; Ulukanli, Sabri","Synthesis of chiral sulfoximines derived from 3-aminoquinazolinones and their catalysis of enantioselective diethylzinc addition to aldehydes.","Organic & biomolecular chemistry","2011","9","22","7887","7896","10.1039/c1ob06205k","","","0.71073","MoKα","","0.084","0.0519","","","0.123","0.1461","","","","","","1.073","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152063","9.1743","0.0003","9.9834","0.0004","13.0708","0.0004","79.253","0.003","76.645","0.003","86.29","0.003","1144.07","0.07","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H25.2 N O4.1 S2 -","- C25 H25 N O4.1 S2 -","- C50 H50 N2 O8.2 S4 -","2","1","","Camp, Jason E.; Craig, Donald; Funai, Kiyohiko; White, Andrew J. P.","Decarboxylative Claisen rearrangement reactions: synthesis and reactivity of alkylidene-substituted indolines.","Organic & biomolecular chemistry","2011","9","22","7904","7912","10.1039/c1ob06212c","","","0.71073","MoKα","","0.0569","0.0392","","","0.0991","0.1024","","","","","","0.988","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7152064","23.93","0.003","9.1192","0.0004","17.171","0.002","90","","134.52","0.02","90","","2671.7","1","298","2","298","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","12b-Hydroxy-3-bromo-5,12b-dihydro-6H-isoindolo[1,2-a]isoquinolin-8-one","12b-Hydroxy-3-bromo-5,12b-dihydro-6H-isoindolo[1,2-a]isoquinolin-8-one","","- C16 H12 Br N O2 -","- C16 H12 Br N O2 -","- C128 H96 Br8 N8 O16 -","8","1","","Selvakumar, Jayaraman; Ramanathan, Chinnasamy Ramaraj","Brønsted acid assisted activation of imide carbonyl group: regioselective synthesis of isoindoloisoquinolinone alkaloid (±)-nuevamine.","Organic & biomolecular chemistry","2011","9","22","7643","7646","10.1039/c1ob06349a","","","0.71073","MoKα","","0.053107","0.039394","","","","0.065956","","","","","","1.02533","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7152065","7.9048","0.0008","7.9136","0.0011","10.4368","0.0015","78.413","0.013","87.471","0.01","76.97","0.01","623.11","0.14","293","2","293","2","","","","","","","","4","P -1","-P 1","2","12b-Hydroxy-5,12b-dihydro-6H-isoindolo[1,2-a]isoquinolin-8-one","12b-Hydroxy-5,12b-dihydro-6H-isoindolo[1,2-a]isoquinolin-8-one","","- C16 H13 N O2 -","- C16 H13 N O2 -","- C32 H26 N2 O4 -","2","1","","Selvakumar, Jayaraman; Ramanathan, Chinnasamy Ramaraj","Brønsted acid assisted activation of imide carbonyl group: regioselective synthesis of isoindoloisoquinolinone alkaloid (±)-nuevamine.","Organic & biomolecular chemistry","2011","9","22","7643","7646","10.1039/c1ob06349a","","","0.71073","MoKα","","0.1041","0.063","","","0.1558","0.1769","","","","","","1.044","","","","has coordinates","206489","2020-10-21","18:00:00",""
"7152066","11.3081","0.0006","6.5772","0.0004","20.0573","0.0013","90","","90","","90","","1491.77","0.15","298","2","298","2","","","","","","","","4","P n 21 a","P -2ac -2n","33","12b-Hydroxy-1,4-dimethoxy-5,12b-dihydro-6H-isoindolo[1,2-a]isoquinolin-8-one","12b-Hydroxy-1,4-dimethoxy-5,12b-dihydro-6H-isoindolo[1,2-a]isoquinolin-8-one","","- C18 H17 N O4 -","- C18 H17 N O4 -","- C72 H68 N4 O16 -","4","1","","Selvakumar, Jayaraman; Ramanathan, Chinnasamy Ramaraj","Brønsted acid assisted activation of imide carbonyl group: regioselective synthesis of isoindoloisoquinolinone alkaloid (±)-nuevamine.","Organic & biomolecular chemistry","2011","9","22","7643","7646","10.1039/c1ob06349a","","","0.71073","MoKα","","0.0711","0.0337","","","0.0569","0.062","","","","","","0.792","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7152067","10.155","0.0002","19.4043","0.0005","9.8299","0.0003","90","","95.344","0.002","90","","1928.57","0.09","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C20 H21 N O6 -","- C20 H23 N O7 -","- C80 H92 N4 O28 -","4","1","","Selvakumar, Jayaraman; Ramanathan, Chinnasamy Ramaraj","Brønsted acid assisted activation of imide carbonyl group: regioselective synthesis of isoindoloisoquinolinone alkaloid (±)-nuevamine.","Organic & biomolecular chemistry","2011","9","22","7643","7646","10.1039/c1ob06349a","","","0.71073","MoKα","","0.0597","0.0419","","","0.0999","0.1099","","","","","","1.005","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152068","11.7004","0.0012","15.9776","0.0013","7.1602","0.0006","90","","107.25","0.005","90","","1278.4","0.2","180","2","180","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H13 N3 O2 -","- C14 H13 N3 O2 -","- C56 H52 N12 O8 -","4","1","","Zhao, Weiwen; Wang, Ruiyao; Petitjean, Anne","Z-Formamidoximes in molecular folding and macrocycles.","Organic & biomolecular chemistry","2011","9","22","7647","7651","10.1039/c1ob06378b","","","0.71073","MoKα","","0.0717","0.0441","","","0.1017","0.1172","","","","","","1.035","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152069","14.4432","0.0008","14.602","0.0008","14.6895","0.0008","64.035","0.001","76.977","0.001","61.12","","2438.5","0.2","180","2","180","2","","","","","","","","6","P -1","-P 1","2","","","","- C19 H23 F3 N7 O7.5 S -","- C19 H23 F3 N7 O7.5 S -","- C76 H92 F12 N28 O30 S4 -","4","2","","Zhao, Weiwen; Wang, Ruiyao; Petitjean, Anne","Z-Formamidoximes in molecular folding and macrocycles.","Organic & biomolecular chemistry","2011","9","22","7647","7651","10.1039/c1ob06378b","","","0.71073","MoKα","","0.0663","0.0569","","","0.1408","0.1494","","","","","","1.033","","","","has coordinates,has disorder","176453","2020-10-21","18:00:00",""
"7152070","11.3994","0.0002","17.3955","0.0004","25.7476","0.0005","90","","102.612","0.001","90","","4982.51","0.17","180","2","180","2","","","","","","","","4","C 1 c 1","C -2yc","9","","","","- C48 H44 N18 O13 -","- C48 H44 N18 O13 -","- C192 H176 N72 O52 -","4","1","","Zhao, Weiwen; Wang, Ruiyao; Petitjean, Anne","Z-Formamidoximes in molecular folding and macrocycles.","Organic & biomolecular chemistry","2011","9","22","7647","7651","10.1039/c1ob06378b","","","0.71073","MoKα","","0.0742","0.0443","","","0.0898","0.1042","","","","","","1.014","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152071","11.863","0.004","9.081","0.003","10.47","0.004","90","","92.446","0.006","90","","1126.9","0.7","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H15 N O2 -","- C13 H15 N O2 -","- C52 H60 N4 O8 -","4","1","","Patel, Pitambar; Ramana, Chepuri V.","Divergent Pd(ii) and Au(iii) mediated nitroalkynol cycloisomerizations.","Organic & biomolecular chemistry","2011","9","21","7327","7334","10.1039/c0ob00858c","","","0.71073","MoKα","","0.0532","0.0459","","","0.114","0.1194","","","","","","1.083","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152072","5.075","0.002","10.398","0.004","24.245","0.01","90","","96.01","","90","","1272.4","0.9","297","2","297","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H15 N O4 -","- C14 H15 N O4 -","- C56 H60 N4 O16 -","4","1","","Patel, Pitambar; Ramana, Chepuri V.","Divergent Pd(ii) and Au(iii) mediated nitroalkynol cycloisomerizations.","Organic & biomolecular chemistry","2011","9","21","7327","7334","10.1039/c0ob00858c","","","0.71073","MoKα","","0.1332","0.0742","","","0.1322","0.1552","","","","","","1.068","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152073","5.122","0.003","10.084","0.006","16.501","0.01","90","","96.062","0.013","90","","847.5","0.9","200","2","200","2","","","101.325","","","","Synthesis","4","P 1 21 1","P 2yb","4","Boc-Ala-CuM","","","- C17 H21 N O5 -","- C17 H21 N O5 -","- C34 H42 N2 O10 -","2","1","","Bandyopadhyay, Anupam; Gopi, Hosahudya N.","A facile transformation of amino acids to functionalized coumarins.","Organic & biomolecular chemistry","2011","9","23","8089","8095","10.1039/c1ob05815k","","x-ray","0.71073","MoKα","","0.0642","0.0481","","","0.1216","0.1331","","","","","","1.028","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152074","16.779","0.003","10.0638","0.0017","11.0022","0.0019","90","","103.905","0.004","90","","1803.4","0.5","296","2","296","2","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C19 H23 N O5 -","- C19 H23 N O5 -","- C76 H92 N4 O20 -","4","1","","Bandyopadhyay, Anupam; Gopi, Hosahudya N.","A facile transformation of amino acids to functionalized coumarins.","Organic & biomolecular chemistry","2011","9","23","8089","8095","10.1039/c1ob05815k","","","0.71073","MoKα","","0.0409","0.0355","","","0.0896","0.0936","","","","","","1.053","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152075","8.044","0.0002","18.8305","0.0008","11.1262","0.0004","90","","101.736","0.002","90","","1650.08","0.1","120","2","120","2","","","","","","","Pedro Cintas","4","P 1 21/n 1","-P 2yn","14","","","","- C21 H21 N O -","- C21 H21 N O -","- C84 H84 N4 O4 -","4","1","","Martínez, R Fernando; Avalos, Martín; Babiano, Reyes; Cintas, Pedro; Jiménez, José L; Light, Mark E.; Palacios, Juan C.","Tautomerism in Schiff bases. The cases of 2-hydroxy-1-naphthaldehyde and 1-hydroxy-2-naphthaldehyde investigated in solution and the solid state.","Organic & biomolecular chemistry","2011","9","24","8268","8275","10.1039/c1ob06073b","","","0.71073","MoKα","","0.1081","0.0583","","","0.1378","0.1634","","","","","","1.031","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152076","7.6826","0.0002","12.2144","0.0004","15.2964","0.0004","90","","90","","90","","1435.39","0.07","120","2","120","2","","","","","","","Pedro Cintas","4","P 21 21 21","P 2ac 2ab","19","","","","- C19 H17 N O -","- C19 H17 N O -","- C76 H68 N4 O4 -","4","1","","Martínez, R Fernando; Avalos, Martín; Babiano, Reyes; Cintas, Pedro; Jiménez, José L; Light, Mark E.; Palacios, Juan C.","Tautomerism in Schiff bases. The cases of 2-hydroxy-1-naphthaldehyde and 1-hydroxy-2-naphthaldehyde investigated in solution and the solid state.","Organic & biomolecular chemistry","2011","9","24","8268","8275","10.1039/c1ob06073b","","","0.71073","MoKα","","0.0366","0.0333","","","0.08","0.0819","","","","","","1.189","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7152077","8.4367","0.0003","7.7374","0.0003","11.1697","0.0005","90","","90.964","0.003","90","","729.03","0.05","120","2","120","2","","","","","","","Pedro Cintas","4","P 1 21 1","P 2yb","4","","","","- C19 H17 N O -","- C19 H17 N O -","- C38 H34 N2 O2 -","2","1","","Martínez, R Fernando; Avalos, Martín; Babiano, Reyes; Cintas, Pedro; Jiménez, José L; Light, Mark E.; Palacios, Juan C.","Tautomerism in Schiff bases. The cases of 2-hydroxy-1-naphthaldehyde and 1-hydroxy-2-naphthaldehyde investigated in solution and the solid state.","Organic & biomolecular chemistry","2011","9","24","8268","8275","10.1039/c1ob06073b","","","0.71073","MoKα","","0.0739","0.0538","","","0.1057","0.1174","","","","","","1.206","","","","has coordinates","288505","2023-12-22","15:12:04",""
"7152078","8.5131","0.0002","12.4731","0.0004","15.8417","0.0005","90","","103.012","0.002","90","","1638.95","0.08","120","2","120","2","","","","","","","Pedro Cintas","4","P 1 21/n 1","-P 2yn","14","NAFTBU","","","- C21 H21 N O -","- C21 H21 N O -","- C84 H84 N4 O4 -","4","1","","Martínez, R Fernando; Avalos, Martín; Babiano, Reyes; Cintas, Pedro; Jiménez, José L; Light, Mark E.; Palacios, Juan C.","Tautomerism in Schiff bases. The cases of 2-hydroxy-1-naphthaldehyde and 1-hydroxy-2-naphthaldehyde investigated in solution and the solid state.","Organic & biomolecular chemistry","2011","9","24","8268","8275","10.1039/c1ob06073b","","","0.71073","MoKα","","0.0939","0.0571","","","0.1401","0.1604","","","","","","1.054","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152079","17.7484","0.0004","15.5301","0.0004","26.3541","0.0007","90","","106.562","0.001","90","","6962.7","0.3","298","2","298","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C62 H98 N6 O8 S4 -","- C62 H98 N6 O8 S4 -","- C248 H392 N24 O32 S16 -","4","1","","Fuentes de Arriba, Angel L.; Turiel, María G; Simón, Luis; Sanz, Francisca; Boyero, Juan F.; Muñiz, Francisco M; Morán, Joaquín R; Alcázar, Victoria","Sulfonamide carbazole receptors for anion recognition.","Organic & biomolecular chemistry","2011","9","24","8321","8327","10.1039/c1ob06126g","","","1.54178","CuKα","","0.0882","0.0741","","","0.2275","0.2455","","","","","","1.029","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7152080","25.4032","0.0011","25.5614","0.0011","23.8466","0.0008","90","","93.307","0.003","90","","15458.8","1.1","298","2","298","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C36 H31 F12 N3 O4 S2 -","- C36 H31 F12 N3 O4 S2 -","- C576 H496 F192 N48 O64 S32 -","16","2","","Fuentes de Arriba, Angel L.; Turiel, María G; Simón, Luis; Sanz, Francisca; Boyero, Juan F.; Muñiz, Francisco M; Morán, Joaquín R; Alcázar, Victoria","Sulfonamide carbazole receptors for anion recognition.","Organic & biomolecular chemistry","2011","9","24","8321","8327","10.1039/c1ob06126g","","","1.54178","CuKα","","0.1601","0.1261","","","0.3797","0.4047","","","","","","1.055","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7152081","18.6703","0.0005","10.3143","0.0003","25.8835","0.0006","90","","90","","90","","4984.4","0.2","273","2","273","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C44 H51 Cl F12 N4 O4 S2 -","- C44 H51 Cl F12 N4 O4 S2 -","- C176 H204 Cl4 F48 N16 O16 S8 -","4","1","","Fuentes de Arriba, Angel L.; Turiel, María G; Simón, Luis; Sanz, Francisca; Boyero, Juan F.; Muñiz, Francisco M; Morán, Joaquín R; Alcázar, Victoria","Sulfonamide carbazole receptors for anion recognition.","Organic & biomolecular chemistry","2011","9","24","8321","8327","10.1039/c1ob06126g","","","1.54178","CuKα","","0.0922","0.0739","","","0.2217","0.2581","","","","","","1.089","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7152082","18.7203","0.0005","10.3816","0.0003","25.9329","0.0006","90","","90","","90","","5040","0.2","298","2","298","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C44 H51 Br F12 N4 O4 S2 -","- C44 H51 Br F12 N4 O4 S2 -","- C176 H204 Br4 F48 N16 O16 S8 -","4","1","","Fuentes de Arriba, Angel L.; Turiel, María G; Simón, Luis; Sanz, Francisca; Boyero, Juan F.; Muñiz, Francisco M; Morán, Joaquín R; Alcázar, Victoria","Sulfonamide carbazole receptors for anion recognition.","Organic & biomolecular chemistry","2011","9","24","8321","8327","10.1039/c1ob06126g","","","1.54178","CuKα","","0.0615","0.0527","","","0.1505","0.1623","","","","","","1.048","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7152083","18.8303","0.0005","10.4962","0.0003","26.058","0.0007","90","","90","","90","","5150.3","0.2","298","2","298","2","","","","","","","","7","P n a 21","P 2c -2n","33","","","","- C44 H51 F12 I N4 O4 S2 -","- C44 H51 F12 I N4 O4 S2 -","- C176 H204 F48 I4 N16 O16 S8 -","4","1","","Fuentes de Arriba, Angel L.; Turiel, María G; Simón, Luis; Sanz, Francisca; Boyero, Juan F.; Muñiz, Francisco M; Morán, Joaquín R; Alcázar, Victoria","Sulfonamide carbazole receptors for anion recognition.","Organic & biomolecular chemistry","2011","9","24","8321","8327","10.1039/c1ob06126g","","","1.54178","CuKα","","0.0556","0.044","","","0.1169","0.1272","","","","","","1.021","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7152084","7.5836","0.0005","16.6354","0.0015","16.7866","0.001","90","","97.485","0.008","90","","2099.7","0.3","291","2","291","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C24 H15 Cl3 N2 O -","- C24 H15 Cl3 N2 O -","- C96 H60 Cl12 N8 O4 -","4","1","","Grotkopp, Oliver; Ahmad, Atia; Frank, Walter; Müller, Thomas J J","Blue-luminescent 5-(3-indolyl)oxazoles via microwave-assisted three-component coupling-cycloisomerization-Fischer indole synthesis.","Organic & biomolecular chemistry","2011","9","23","8130","8140","10.1039/c1ob06153d","","","0.71073","MoKα","","0.1556","0.0387","","","0.0501","0.0623","","","","","","0.936","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152085","8.751","0.003","10.6327","0.0017","21.676","0.006","90","","100.49","0.03","90","","1983.2","0.9","293","2","293","2","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","1-{4-[1-(pyridin-2-ylmethyl)-1H-1,2,3-triazol-4-yl]phenyl} -3-[4-(trifluoromethyl)phenyl]urea","","- C22 H17 F3 N6 O -","- C22 H17 F3 N6 O -","- C88 H68 F12 N24 O4 -","4","1","","Bergamaschi, Greta; Boiocchi, Massimo; Monzani, Enrico; Amendola, Valeria","Pyridinium/urea-based anion receptor: methine formation in the presence of basic anions.","Organic & biomolecular chemistry","2011","9","24","8276","8283","10.1039/c1ob06193c","","","0.71073","MoKα","","0.0992","0.0737","","","0.1688","0.1916","","","","","","1.057","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152086","4.9152","0.0002","9.6665","0.0004","50.7258","0.0018","90","","90","","90","","2410.12","0.16","193","2","193","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C25 H45 N O3 -","- C25 H45 N O3 -","- C100 H180 N4 O12 -","4","1","","Rives, Arnaud; Baudoin-Dehoux, Cécile; Saffon, Nathalie; Andrieu-Abadie, Nathalie; Génisson, Yves","Asymmetric synthesis and cytotoxic activity of isomeric phytosphingosine derivatives.","Organic & biomolecular chemistry","2011","9","23","8163","8170","10.1039/c1ob06195j","","","0.71073","MoKα","","0.0977","0.0509","","","0.0903","0.1049","","","","","","1.027","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152087","10.2997","0.0005","4.987","0.0003","24.6551","0.0013","90","","92.668","0.004","90","","1265.03","0.12","193","2","193","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H45 N O3 -","- C25 H45 N O3 -","- C50 H90 N2 O6 -","2","1","","Rives, Arnaud; Baudoin-Dehoux, Cécile; Saffon, Nathalie; Andrieu-Abadie, Nathalie; Génisson, Yves","Asymmetric synthesis and cytotoxic activity of isomeric phytosphingosine derivatives.","Organic & biomolecular chemistry","2011","9","23","8163","8170","10.1039/c1ob06195j","","","0.71073","MoKα","","0.0831","0.0545","","","0.1405","0.1557","","","","","","1.071","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152088","9.978","0.003","10.704","0.003","17.817","0.006","74.1","0.02","81.31","0.02","81.28","0.02","1796.9","1","150","1","150","1","","","","","","","synthesis as described","5","P 1","P 1","1","","","","- C38 H28 Cl4 N4 O10 -","- C38 H28 Cl4 N4 O10 -","- C76 H56 Cl8 N8 O20 -","2","2","","Lemouchi, Cyprien; Simonov, Sergey; Zorina, Leokadiya; Gautier, Christelle; Hudhomme, Piétrick; Batail, Patrick","Amino acid derivatives of perylenediimide and their N-HO peptide bond dipoles-templated solid state assembly into stacks.","Organic & biomolecular chemistry","2011","9","23","8096","8101","10.1039/c1ob06213a","","","0.71073","MoKα","","0.1485","0.0713","","","0.1169","0.1354","","","","","","1.015","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152089","10.019","0.002","16.372","0.003","49.573","0.009","90","","90","","90","","8132","3","150","1","150","1","","","","","","","synthesis as described","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H36 Cl4 N4 O10 -","- C42 H36 Cl4 N4 O10 -","- C336 H288 Cl32 N32 O80 -","8","2","","Lemouchi, Cyprien; Simonov, Sergey; Zorina, Leokadiya; Gautier, Christelle; Hudhomme, Piétrick; Batail, Patrick","Amino acid derivatives of perylenediimide and their N-HO peptide bond dipoles-templated solid state assembly into stacks.","Organic & biomolecular chemistry","2011","9","23","8096","8101","10.1039/c1ob06213a","","","0.71073","MoKα","","0.1297","0.0642","","","0.1241","0.1387","","","","","","1.036","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152090","6.3355","0.0006","7.439","0.0008","26.291","0.002","90","","90","","90","","1239.1","0.2","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","(R)-2-[(R)-1-hydroxy-3-phenylpropyl]piperidine","","- C14 H21 N O -","- C14 H21 N O -","- C56 H84 N4 O4 -","4","1","","Gálvez, José A; Díaz de Villegas, María D; Badorrey, Ramón; López-Ram-de-Víu, Pilar","Switch in regioselectivity of epoxide ring-opening by changing the organometallic reagent.","Organic & biomolecular chemistry","2011","9","23","8155","8162","10.1039/c1ob06216f","","","0.71073","MoKα","","0.0944","0.052","","","0.0762","0.0836","","","","","","0.894","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152091","9.8157","0.0004","15.5367","0.0005","14.1068","0.0007","90","","98.289","0.004","90","","2128.86","0.15","293","2","293","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C19 H27 N O4 Si -","- C19 H27 N O4 Si -","- C76 H108 N4 O16 Si4 -","4","1","","More, Vijaykumar; Di Mola, Antonia; Croce, Gianluca; Tedesco, Consiglia; Petronzi, Carmen; Peduto, Antonella; De Caprariis, Paolo; Filosa, Rosanna; Massa, Antonio","Multi-component, regio-selective aldol addition of β-ketoesters to aldehydes: scope and applications.","Organic & biomolecular chemistry","2011","9","24","8483","8488","10.1039/c1ob06229h","","","0.71073","MoKα","","0.1271","0.0647","","","0.1751","0.2241","","","","","","0.978","","","","has coordinates","181910","2020-10-21","18:00:00",""
"7152092","6.155","0.005","9.28","0.005","14.021","0.005","80.62","0.005","86.561","0.005","70.941","0.005","746.8","0.8","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C7.5 H8.5 O2 -","- C15 H22 O4 -","- C30 H44 O8 -","2","1","","More, Vijaykumar; Di Mola, Antonia; Croce, Gianluca; Tedesco, Consiglia; Petronzi, Carmen; Peduto, Antonella; De Caprariis, Paolo; Filosa, Rosanna; Massa, Antonio","Multi-component, regio-selective aldol addition of β-ketoesters to aldehydes: scope and applications.","Organic & biomolecular chemistry","2011","9","24","8483","8488","10.1039/c1ob06229h","","","0.71073","MoKα","","0.3505","0.1109","","","0.1906","0.3031","","","","","","0.918","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7152093","9.1149","0.0011","6.9784","0.0008","14.9231","0.0015","90","","98.171","0.007","90","","939.58","0.18","293","2","293","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","rac-7-hydroxy-2-oxaspiro(5.5)undec-8-en-1-one","rac-7-hydroxy-2-oxaspiro[5.5]undec-8-en-1-one","","- C10 H14 O3 -","- C10 H14 O3 -","- C40 H56 O12 -","4","1","","Duroure, Leslie; Jousseaume, Thierry; Aráoz, Rómulo; Barré, Elvina; Retailleau, Pascal; Chabaud, Laurent; Molgó, Jordi; Guillou, Catherine","6,6-Spiroimine analogs of (-)-gymnodimine A: synthesis and biological evaluation on nicotinic acetylcholine receptors.","Organic & biomolecular chemistry","2011","9","23","8112","8118","10.1039/c1ob06257c","","","1.54187","CuKα","","0.0682","0.0524","","","0.1617","0.1804","","","","","","1.091","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152094","5.919","0.003","14.531","0.005","25.735","0.011","90","","90","","90","","2213.4","1.7","105","2","105","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C24 H22 O6 S2 -","- C24 H22 O6 S2 -","- C96 H88 O24 S8 -","4","1","","Companyó, Xavier; Valero, Guillem; Ceban, Victor; Calvet, Teresa; Font-Bardía, Mercé; Moyano, Albert; Rios, Ramon","Enantioselective organocatalytic asymmetric allylic alkylation. Bis(phenylsulfonyl)methane addition to MBH carbonates.","Organic & biomolecular chemistry","2011","9","23","7986","7989","10.1039/c1ob06308a","","","0.71073","MoKα","","0.0965","0.0779","","","0.1815","0.2035","","","","","","1.098","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152095","7.1296","0.0002","9.0495","0.0004","27.5442","0.001","90","","90","","90","","1777.13","0.11","130","","130","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 O9 -","- C16 H20 O9 -","- C64 H80 O36 -","4","1","","Leaver, David J.; Dawson, Raymond M.; White, Jonathan M.; Polyzos, Anastasios; Hughes, Andrew B.","Synthesis of 1,2,3-triazole linked galactopyranosides and evaluation of cholera toxin inhibition.","Organic & biomolecular chemistry","2011","9","24","8465","8474","10.1039/c1ob06317k","","","1.5418","CuKα","","0.0365","0.036","","","0.0956","0.0961","","","","","","1.058","","","","has coordinates,has disorder","180306","2020-10-21","18:00:00",""
"7152096","18.1428","0.0008","8.3337","0.0005","11.7816","0.0009","90","","94.391","0.006","90","","1776.11","0.19","130","","130","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C16 H20 O9 -","- C16 H20 O9 -","- C64 H80 O36 -","4","1","","Leaver, David J.; Dawson, Raymond M.; White, Jonathan M.; Polyzos, Anastasios; Hughes, Andrew B.","Synthesis of 1,2,3-triazole linked galactopyranosides and evaluation of cholera toxin inhibition.","Organic & biomolecular chemistry","2011","9","24","8465","8474","10.1039/c1ob06317k","","","0.7107","MoKα","","0.0438","0.0374","","","0.0861","0.0906","","","","","","1.071","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152097","10.2837","0.0002","16.8731","0.0003","12.5611","0.0002","90","","109.192","0.001","90","","2058.44","0.06","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C44 H52 N6 O6 -","- C44 H52 N6 O6 -","- C88 H104 N12 O12 -","2","1","","Oh, Joong-Suk; Kim, Kyung Il; Song, Choong Eui","Enantioselective synthesis of α-deuterium labelled chiral α-amino acids via dynamic kinetic resolution of racemic azlactones.","Organic & biomolecular chemistry","2011","9","23","7983","7985","10.1039/c1ob06319g","","","0.71073","MoKα","","0.0721","0.0432","","","0.0963","0.106","","","","","","0.935","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152098","9.3525","0.0004","10.0265","0.0005","10.842","0.0005","113.426","0.002","96.914","0.002","97.59","0.002","907.85","0.08","296","2","296","2","","","","","","","","4","P -1","-P 1","2","pyrazolobenzoxazine","","","- C20 H17 N3 O5 -","- C20 H17 N3 O5 -","- C40 H34 N6 O10 -","2","1","","Brahma, Kaushik; Sasmal, Anup Kumar; Chowdhury, Chinmay","An efficient strategy for the general synthesis of 3-aryl substituted pyrazolo[5,1-c][1,4]benzoxazines and pyrazolo[1,5-a][1,4]benzodiazepin-6(4H)-ones.","Organic & biomolecular chemistry","2011","9","24","8422","8429","10.1039/c1ob06353g","","","0.71073","MoKα","","0.054","0.0477","","","0.1255","0.1369","","","","","","0.674","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152099","5.4376","0.0007","9.7637","0.0012","22.815","0.003","90","","90","","90","","1211.3","0.3","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H13 I O -","- C13 H13 I O -","- C52 H52 I4 O4 -","4","1","","Duce, Sara; Jorge, María; Alonso, Inés; Ruano, José Luis García; Cid, M Belén","An organocatalytic approach to enantiomerically enriched α-arylcyclohexenones and cyclohexanones.","Organic & biomolecular chemistry","2011","9","24","8253","8260","10.1039/c1ob06356a","","","0.71073","MoKα","","0.0393","0.0291","","","0.0586","0.064","","","","","","1.089","","","","has coordinates","180306","2020-10-21","18:00:00",""
"7152100","11.207","0.002","12.542","0.003","15.394","0.003","70.9","0.03","85.07","0.03","89.15","0.03","2036.9","0.8","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C38 H54 N4 O2 S4 -","- C38 H54 N4 O2 S4 -","- C76 H108 N8 O4 S8 -","2","1","","Chen, Cheng; Dong, Haijun; Chen, Yaqing; Guo, Liangqia; Wang, Zhenyu; Sun, Jian-Jun; Fu, Nanyan","Dual-mode unsymmetrical squaraine-based sensor for selective detection of Hg(2+) in aqueous media.","Organic & biomolecular chemistry","2011","9","23","8195","8201","10.1039/c1ob06519j","","","0.71073","MoKα","","0.186","0.1262","","","0.2922","0.3362","","","","","","1.158","","","","has coordinates,has disorder","198633","2020-10-21","18:00:00",""
"7153081","14.5489","0.0017","31.423","0.009","11.609","0.0013","90","","118.413","0.008","90","","4668","1.6","298.1","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C54 H56 O8 -","- C54 H56 O8 -","- C216 H224 O32 -","4","0.5","","Ito, Yosuke; Tomiyasu, Yuichi; Kawanabe, Takahiro; Uemura, Keisuke; Ushimizu, Yuu; Nishino, Hiroshi","One-pot synthesis of cyclophane-type macrocycles using manganese(III)-mediated oxidative radical cyclization.","Organic & biomolecular chemistry","2011","9","5","1491","1507","10.1039/c0ob00683a","","","0.71069","MoKα","","","0.0878","","","","0.1042","","","","","","4.749","","","","has coordinates","295965","2024-11-17","17:32:34",""
"7153082","8.046","0.001","14.28","0.002","22.646","0.003","90","","90","","90","","2602","0.6","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C27 H34 N2 O4 -","- C27 H34 N2 O4 -","- C108 H136 N8 O16 -","4","1","","Jones, Raymond C. F.; Howard, Kevin J.; Snaith, John S.; Blake, Alexander J.; Li, Wang-Shei; Steel, Peter J.","Cycloaddition of homochiral dihydroimidazoles: a 1,3-dipolar cycloaddition route to optically active pyrrolo[1,2-a]imidazoles.","Organic & biomolecular chemistry","2011","9","1","297","306","10.1039/c0ob00529k","","","0.71073","MoKα","","0.0854","0.0418","","","0.0939","0.1034","","","","","","0.807","","","","has coordinates","180316","2020-10-21","18:00:00",""
"7153083","10.276","0.002","5.799","0.003","20.259","0.005","90","","103.07","0.02","90","","1176","0.7","150","0.2","150","0.2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C26 H32 N2 O4 -","- C26 H32 N2 O4 -","- C52 H64 N4 O8 -","2","1","","Jones, Raymond C. F.; Howard, Kevin J.; Snaith, John S.; Blake, Alexander J.; Li, Wang-Shei; Steel, Peter J.","Cycloaddition of homochiral dihydroimidazoles: a 1,3-dipolar cycloaddition route to optically active pyrrolo[1,2-a]imidazoles.","Organic & biomolecular chemistry","2011","9","1","297","306","10.1039/c0ob00529k","","","0.71073","MoKα","","0.1226","0.0734","","0.1465","0.117","","","","1.253","1.213","1.213","","","","","has coordinates","180316","2020-10-21","18:00:00",""
"7153084","11.351","0.002","9.7612","0.001","19.942","0.003","90","","91.07","0.02","90","","2209.2","0.6","293","2","293","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C25 H28 N2 O4 -","- C25 H28 N2 O4 -","- C100 H112 N8 O16 -","4","2","","Jones, Raymond C. F.; Howard, Kevin J.; Snaith, John S.; Blake, Alexander J.; Li, Wang-Shei; Steel, Peter J.","Cycloaddition of homochiral dihydroimidazoles: a 1,3-dipolar cycloaddition route to optically active pyrrolo[1,2-a]imidazoles.","Organic & biomolecular chemistry","2011","9","1","297","306","10.1039/c0ob00529k","","","0.71073","MoKα","","0.0936","0.0494","","0.141","0.1","","","","1.006","1.059","1.059","","","","","has coordinates","180316","2020-10-21","18:00:00",""
"7153803","5.2851","0.0001","15.1376","0.0004","8.295","0.0002","90","","94.61","0.001","90","","661.48","0.03","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C14 H20 O4 -","- C14 H20 O4 -","- C28 H40 O8 -","2","1","","Clark, J. Stephen; Labre, Flavien; Thomas, Lynne H.","Concise synthesis of the C-1-C-12 fragment of amphidinolides T1-T5.","Organic & biomolecular chemistry","2011","9","13","4823","4830","10.1039/c1ob05130j","","","0.71073","MoKα","","0.0577","0.0392","","","","0.0866","","","","","","0.939","","","","has coordinates,has disorder","180324","2020-10-21","18:00:00",""