# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-07-29T01:03:56+02:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Tetrahedron') AND volume = 76 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
"1566133","11.34175","0.00018","8.21411","0.00013","12.44906","0.00019","90","","107.158","0.0016","90","","1108.17","0.03","99.98","0.12","99.98","0.12","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C24 H33 N O5 -","- C24 H33 N O5 -","- C48 H66 N2 O10 -","2","1","","Quy, Alex S.; Li, Xingjian; Male, Louise; Stankovic, Tatjana; Agathanggelou, Angelo; Fossey, John S.","Aniline-containing derivatives of parthenolide: Synthesis and anti-chronic lymphocytic leukaemia activity","Tetrahedron","2020","76","48","131631","","10.1016/j.tet.2020.131631","","x-ray","1.54184","CuKα","","0.0345","0.0323","","","0.0837","0.0857","","","","","","1.043","","","","has coordinates","272246","2022-01-26","12:29:17",""
"1566134","11.1281","0.0003","7.1835","0.0002","11.805","0.0003","90","","93.143","0.002","90","","942.26","0.04","100","0.1","100","0.1","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C22 H29 N O3 -","- C22 H29 N O3 -","- C44 H58 N2 O6 -","2","1","","Quy, Alex S.; Li, Xingjian; Male, Louise; Stankovic, Tatjana; Agathanggelou, Angelo; Fossey, John S.","Aniline-containing derivatives of parthenolide: Synthesis and anti-chronic lymphocytic leukaemia activity","Tetrahedron","2020","76","48","131631","","10.1016/j.tet.2020.131631","","x-ray","1.54184","CuKα","","0.0303","0.0287","","","0.0708","0.0719","","","","","","1.003","","","","has coordinates","272247","2022-01-26","12:30:19",""
"1566135","6.42575","0.00009","25.7445","0.0003","9.53536","0.00012","90","","105.067","0.0013","90","","1523.18","0.03","99.9","0.5","99.9","0.5","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C16 H25 O4.5 -","- C16 H25 O4.5 -","- C64 H100 O18 -","4","2","","Quy, Alex S.; Li, Xingjian; Male, Louise; Stankovic, Tatjana; Agathanggelou, Angelo; Fossey, John S.","Aniline-containing derivatives of parthenolide: Synthesis and anti-chronic lymphocytic leukaemia activity","Tetrahedron","2020","76","48","131631","","10.1016/j.tet.2020.131631","","x-ray","1.54184","CuKα","","0.0283","0.0264","","","0.0622","0.0637","","","","","","1.031","","","","has coordinates","275856","2022-06-07","07:08:28",""
"1566137","11.3635","0.0006","24.9442","0.0016","10.1321","0.0005","90","","101.394","0.005","90","","2815.4","0.3","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H32 B2 O8 S2 -","- C26 H32 B2 O8 S2 -","- C104 H128 B8 O32 S8 -","4","1","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","x-ray","0.71073","MoKα","","0.0764","0.0579","","","0.1423","0.1554","","","","","","1.029","","","","has coordinates,has disorder","272250","2022-01-26","12:50:05",""
"1566138","36.788","0.003","9.326","0.001","17.102","0.001","90","","101.293","0.009","90","","5753.8","0.9","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C55 H74 B4 O11 Si2 -","- C55 H74 B4 O11 Si2 -","- C220 H296 B16 O44 Si8 -","4","0.5","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","x-ray","1.54184","CuKα","","0.0984","0.0805","","","0.2419","0.2665","","","","","","1.03","","","","has coordinates","272250","2022-01-26","12:50:06",""
"1566139","7.3773","0.0008","20.523","0.003","12.5623","0.0019","90","","102.694","0.014","90","","1855.5","0.5","293","2","293","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 Cl2 O4 -","- C22 H16 Cl2 O4 -","- C88 H64 Cl8 O16 -","4","1","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","x-ray","0.71073","MoKα","","0.1134","0.0597","","","0.0864","0.1023","","","","","","1.032","","","","has coordinates","272250","2022-01-26","12:50:06",""
"1566140","12.5963","0.0003","14.7352","0.0004","16.1555","0.0005","90","","90","","90","","2998.61","0.14","293","2","293","2","","","","","","","","4","P n m a","-P 2ac 2n","62","","","","- C32 H36 B2 O6 -","- C32 H36 B2 O6 -","- C128 H144 B8 O24 -","4","0.5","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","","1.54184","CuKα","","0.1226","0.0941","","","0.2729","0.2939","","","","","","1.038","","","","has coordinates","272250","2022-01-26","12:50:06",""
"1566141","9.1909","0.0007","20.3736","0.0017","17.2816","0.0012","90","","102.298","0.007","90","","3161.8","0.4","293","2","293","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C15 H7 Cl2 F3 O3 S -","- C15 H7 Cl2 F3 O3 S -","- C120 H56 Cl16 F24 O24 S8 -","8","1","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","","0.71073","MoKα","","0.1441","0.1193","","","0.3755","0.4091","","","","","","1.59","","","","has coordinates,has disorder","272250","2022-01-26","12:50:06",""
"1566142","7.4165","0.0006","10.6043","0.0007","14.6106","0.0008","90","","90.624","0.006","90","","1149.01","0.14","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H8 Cl2 O -","- C14 H8 Cl2 O -","- C56 H32 Cl8 O4 -","4","1","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","","0.71073","MoKα","","0.0539","0.0401","","","0.0886","0.0953","","","","","","1.069","","","","has coordinates","272250","2022-01-26","12:50:06",""
"1566143","7.7477","0.0002","7.7582","0.0002","20.4902","0.0005","90","","108.504","0.002","90","","1167.96","0.05","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H8 Cl2 O2 -","- C14 H8 Cl2 O2 -","- C56 H32 Cl8 O8 -","4","1","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","x-ray","1.54184","CuKα","","0.0396","0.0357","","","0.1171","0.1237","","","","","","0.956","","","","has coordinates","272250","2022-01-26","12:50:06",""
"1566144","7.7651","0.0005","21.4851","0.0014","7.2877","0.0004","90","","94.017","0.006","90","","1212.85","0.13","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H10 Cl2 O2 -","- C14 H10 Cl2 O2 -","- C56 H40 Cl8 O8 -","4","1","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","","0.71073","MoKα","","0.0683","0.0624","","","0.1528","0.157","","","","","","1.121","","","","has coordinates","272250","2022-01-26","12:50:07",""
"1566145","7.2545","0.0006","7.8698","0.0006","10.9539","0.001","93.774","0.007","103.555","0.008","92.372","0.007","605.59","0.09","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C14 H10 Cl2 O2 -","- C14 H10 Cl2 O2 -","- C28 H20 Cl4 O4 -","2","1","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","","0.71073","MoKα","","0.0618","0.0511","","","0.1175","0.1239","","","","","","1.111","","","","has coordinates","272250","2022-01-26","12:50:07",""
"1566146","6.9873","0.0004","7.9428","0.0004","11.0964","0.0006","93.205","0.004","94.213","0.004","109.868","0.005","575.46","0.06","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","","","- C11 H15 B O3 -","- C11 H15 B O3 -","- C22 H30 B2 O6 -","2","1","","Forensi, Silvia; Stopin, Antoine; de Leo, Federica; Wouters, Johan; Bonifazi, Davide","1,8,10-Trisubstituted anthracenyl hydrocarbons: Towards versatile scaffolds for multiple-H-bonded recognition arrays","Tetrahedron","2020","76","51","131299","","10.1016/j.tet.2020.131299","","","0.71073","MoKα","","0.0554","0.0498","","","0.1523","0.1586","","","","","","1.085","","","","has coordinates","272250","2022-01-26","12:50:07",""