# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-05-29T01:20:05+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 'Macromolecules') AND volume = 43 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
"1502770","8.628","0.0003","14.8751","0.0005","17.4444","0.0006","90","","90","","90","","2238.86","0.13","100","2","100","2","","","","","","","","6","P n a 21","P 2c -2n","33","","","","- C23 H17 I2 N O2 S2 -","- C23 H17 I2 N O2 S2 -","- C92 H68 I8 N4 O8 S8 -","4","1","","Song, Changsik; Walker, D. Barney; Swager, Timothy M.","Conducting Thiophene-Annulated Azepine Polymers","Macromolecules","2010","43","12","5233","","10.1021/ma100549w","","","0.71073","MoKα","","0.0195","0.0191","","","0.0525","0.0527","","","","","","1.057","","","","has coordinates","301775","2025-08-18","14:01:18",""
"1502771","8.9304","0.0013","10.2803","0.0015","10.9208","0.0018","107.466","0.004","90.523","0.004","104.484","0.003","922.1","0.2","93","2","93","2","","","","","","","","5","P -1","-P 1","2","","","","- C25 H18 B N O -","- C25 H18 B N O -","- C50 H36 B2 N2 O2 -","2","1","","Tokoro, Yuichiro; Nagai, Atsushi; Chujo, Yoshiki","Synthesis of π-Conjugated Polymers Containing Organoboron Benzo[h]quinolate in the Main Chain","Macromolecules","2010","43","14","6229","","10.1021/ma100814v","","","0.71075","MoKα","","0.1189","0.0676","","","0.1534","0.1908","","","","","","0.951","","","","has coordinates","301775","2025-08-18","14:01:18",""
"1502772","17.0896","0.0004","7.5023","0.0001","16.288","0.0003","90","","100.417","0.001","90","","2053.89","0.07","123","2","123","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C26 H20 N2 O S2 -","- C26 H20 N2 O S2 -","- C104 H80 N8 O4 S8 -","4","1","","Häussler, Matthias; Lok, Y. Phei; Chen, Ming; Jasieniak, Jacek; Adhikari, Raju; King, Simon P.; Haque, Saif A.; Forsyth, Craig M.; Winzenberg, Kevin; Watkins, Scott E.; Rizzardo, Ezio; Wilson, Gerard J.","Benzothiadiazole-Containing Pendant Polymers Prepared by RAFT and Their Electro-Optical Properties","Macromolecules","2010","43","17","7101","","10.1021/ma1008572","","","0.71073","MoKα","","0.1042","0.0564","","","0.1281","0.1522","","","","","","1.04","","","","has coordinates","301775","2025-08-18","14:01:18",""
"1502773","13.032","0.004","14.817","0.005","17.543","0.006","90","","90","","90","","3387.5","1.9","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C30 H53 Mg N3 O2 Si2 -","- C30 H53 Mg N3 O2 Si2 -","- C120 H212 Mg4 N12 O8 Si8 -","4","1","","Wang, Liying; Ma, Haiyan","Highly Active Magnesium Initiators for Ring-Opening Polymerization ofrac-Lactide","Macromolecules","2010","43","16","6535","","10.1021/ma101263g","","","0.71073","MoKα","","0.1103","0.0463","","","0.0633","0.0735","","","","","","0.744","","","","has coordinates","301775","2025-08-18","14:01:18",""
"1502774","9.1654","0.0008","17.1904","0.0015","21.4248","0.0019","106.018","0.002","97.63","0.002","97.011","0.002","3170.9","0.5","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H52 N2 Zr -","- C32 H52 N2 Zr -","- C128 H208 N8 Zr4 -","4","2","","Kuhlman, Roger L.; Klosin, Jerzy","Tuning Block Compositions of Polyethylene Multi-Block Copolymers by Catalyst Selection","Macromolecules","2010","43","19","7903","","10.1021/ma101544n","","","0.71073","MoKα","","0.0783","0.0533","","","0.1236","0.1392","","","","","","1.019","","","","has coordinates,has disorder","301775","2025-08-18","14:01:18",""
"1502775","9.1512","0.0004","17.1942","0.0007","21.2757","0.0009","105.558","0.001","97.417","0.001","96.995","0.001","3154.9","0.2","173","2","173","2","","","","","","","","4","P -1","-P 1","2","","","","- C32 H52 Hf N2 -","- C32 H52 Hf N2 -","- C128 H208 Hf4 N8 -","4","2","","Kuhlman, Roger L.; Klosin, Jerzy","Tuning Block Compositions of Polyethylene Multi-Block Copolymers by Catalyst Selection","Macromolecules","2010","43","19","7903","","10.1021/ma101544n","","","0.71073","MoKα","","0.0521","0.0416","","","0.0955","0.1013","","","","","","1.048","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1502776","17.7939","0.0019","9.7642","0.001","17.6714","0.0019","90","","99.741","0.002","90","","3026","0.6","293","2","293","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C28 H52 Hf N2 -","- C28 H52 Hf N2 -","- C112 H208 Hf4 N8 -","4","1","","Kuhlman, Roger L.; Klosin, Jerzy","Tuning Block Compositions of Polyethylene Multi-Block Copolymers by Catalyst Selection","Macromolecules","2010","43","19","7903","","10.1021/ma101544n","","","0.71073","MoKα","","0.0621","0.0407","","","0.1024","0.1223","","","","","","1.044","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00",""
"1502777","28.29","0.03","29.3","0.03","8.01","0.008","90","","90","","90","","6639","12","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C57 H116 O40 -","- C42 H49 O35 -","- C168 H196 O140 -","4","1","","Nishiyama, Yoshiharu; Mazeau, Karim; Morin, Morgane; Cardoso, Mateus B.; Chanzy, Henri; Putaux, Jean-Luc","Molecular and Crystal Structure of 7-Fold V-Amylose Complexed with 2-Propanol","Macromolecules","2010","43","20","8628","","10.1021/ma101794w","","","0.02508","","","0.3641","0.3419","","","0.5942","0.6098","","","","","","99.999","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1502778","10.084","0.002","14.552","0.004","24.36","0.006","90","","90","","90","","3574.6","1.5","293.1","","","","","","","","","","","6","P b c a","-P 2ac 2ab","61","","","","- C20 H12 Br2 N2 Ni O2 -","- C20 H12 Br2 N2 Ni O2 -","- C160 H96 Br16 N16 Ni8 O16 -","8","1","","Fukumoto, Hiroki; Yamane, Kazuto; Kase, Yumiko; Yamamoto, Takakazu","π-Conjugated Poly(aryleneethynylene)s Consisting of Salophen and Ni−Salophen Units in the π-Conjugated Main Chain: Preparation and Chemical Properties","Macromolecules","2010","43","24","10366","","10.1021/ma101800f","","","0.7107","MoKα","","","0.0518","","","","0.0681","","","","","","0.838","","","","has coordinates","301775","2025-08-18","14:01:18",""
"1502779","11.081","0.002","25.643","0.005","12.99","0.003","90","","102.64","0.03","90","","3601.7","1.3","296","2","296","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H39 Br Ir N3 -","- C41 H39 Br Ir N3 -","- C164 H156 Br4 Ir4 N12 -","4","1","","Yan, Qifan; Yue, Kan; Yu, Chao; Zhao, Dahui","Oligo- and Polyfluorene-Tetheredfac-Ir(ppy)3: Substitution Effects","Macromolecules","2010","43","20","8479","","10.1021/ma101821z","","","0.71073","MoKα","","0.1253","0.0492","","","0.0671","0.0743","","","","","","1.031","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1502780","11.597","0.002","19.586","0.004","15.383","0.003","90","","100.67","0.03","90","","3433.7","1.2","123","2","123","2","","","","","","","","5","C 1 c 1","C -2yc","9","","","","- C41 H39 Br Ir N3 -","- C41 H39 Br Ir N3 -","- C164 H156 Br4 Ir4 N12 -","4","1","","Yan, Qifan; Yue, Kan; Yu, Chao; Zhao, Dahui","Oligo- and Polyfluorene-Tetheredfac-Ir(ppy)3: Substitution Effects","Macromolecules","2010","43","20","8479","","10.1021/ma101821z","","","0.71073","MoKα","","0.05","0.0426","","","0.1061","0.1086","","","","","","0.998","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1502781","11.015","0.002","25.825","0.005","12.846","0.003","90","","102.17","0.03","90","","3572.1","1.3","296","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C41 H38 Br2 Ir N3 -","- C41 H38 Br2 Ir N3 -","- C164 H152 Br8 Ir4 N12 -","4","1","","Yan, Qifan; Yue, Kan; Yu, Chao; Zhao, Dahui","Oligo- and Polyfluorene-Tetheredfac-Ir(ppy)3: Substitution Effects","Macromolecules","2010","43","20","8479","","10.1021/ma101821z","","","0.71073","MoKα","","0.1399","0.0684","","","0.1432","0.1603","","","","","","1.012","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1502782","7.4515","0.0007","11.6557","0.0014","15.1935","0.0015","110.611","0.003","93.971","0.003","92.562","0.004","1228.8","0.2","93","2","93","2","","","","","","","","6","P -1","-P 1","2","","","","- C29 H17 B F2 I2 N2 -","- C29 H17 B F2 I2 N2 -","- C58 H34 B2 F4 I4 N4 -","2","1","","Nagai, Atsushi; Chujo, Yoshiki","Aromatic Ring-Fused BODIPY-Based Conjugated Polymers Exhibiting Narrow Near-Infrared Emission Bands","Macromolecules","2010","43","1","193","","10.1021/ma901449c","","","0.71075","MoKα","","0.0817","0.0586","","","0.1523","0.1729","","","","","","1.134","","","","has coordinates","176432","2020-10-21","18:00:00",""
"1502783","12.4453","0.0004","13.3899","0.0004","16.7988","0.0005","107.042","0.003","91.713","0.003","115.539","0.003","2375","0.15","173","2","173","2","","","","","","","","3","P -1","-P 1","2","","","","- C50 H62 Si3 -","- C50 H62 Si3 -","- C100 H124 Si6 -","2","1","","Liu, Jianzhao; Zhong, Yongchun; Lam, Jacky W. Y.; Lu, Ping; Hong, Yuning; Yu, Yong; Yue, Yanan; Faisal, Mahtab; Sung, Herman H. Y.; Williams, Ian D.; Wong, Kam Sing; Tang, Ben Zhong","Hyperbranched Conjugated Polysiloles: Synthesis, Structure, Aggregation-Enhanced Emission, Multicolor Fluorescent Photopatterning, and Superamplified Detection of Explosives","Macromolecules","2010","43","11","4921","","10.1021/ma902432m","","","1.54178","CuKα","","0.0657","0.0566","","","0.1488","0.1573","","","","","","1.007","","","","has coordinates,has disorder","301775","2025-08-18","14:01:18",""
"1502784","14.532","0.003","16.824","0.003","17.536","0.004","64.33","0.03","89.93","0.03","71.81","0.03","3625.8","1.9","223","2","223","2","","","","","","","","8","P -1","-P 1","2","","","","- C78 H57 B Cl2 F20 N2 Ni O2 -","- C78 H57 B Cl2 F20 N2 Ni O2 -","- C156 H114 B2 Cl4 F40 N4 Ni2 O4 -","2","1","","Wegner, Marcus M.; Ott, Anna K.; Rieger, Bernhard","Gas Phase Polymerization of Ethylene with Supported α-Diimine Nickel(II) Catalysts","Macromolecules","2010","43","8","3624","","10.1021/ma9025256","","","0.71073","MoKα","","0.1087","0.0538","","","0.1213","0.1387","","","","","","0.874","","","","has coordinates","301775","2025-08-18","14:01:18",""
"1502785","10.0735","0.0002","13.7187","0.0003","19.7827","0.0005","77.02","0.002","78.813","0.002","80.483","0.002","2592.12","0.1","173","2","173","2","","","","","","","","5","P -1","-P 1","2","","","","- C49 H74 Co3 N4 O10 -","- C49 H74 Co3 N4 O10 -","- C98 H148 Co6 N8 O20 -","2","1","","Kember, Michael R.; White, Andrew J. P.; Williams, Charlotte K.","Highly Active Di- and Trimetallic Cobalt Catalysts for the Copolymerization of CHO and CO2at Atmospheric Pressure","Macromolecules","2010","43","5","2291","","10.1021/ma902582m","","","0.71073","MoKα","","0.0734","0.044","","","0.113","0.1183","","","","","","0.951","","","","has coordinates,has disorder","301775","2025-08-18","14:01:18",""
"1502786","40.1077","0.0018","11.9548","0.0003","27.7661","0.0012","90","","128.183","0.007","90","","10464.8","1.2","173","2","173","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C49 H86 Co2 N4 O9 -","- C49 H86 Co2 N4 O9 -","- C392 H688 Co16 N32 O72 -","8","1","","Kember, Michael R.; White, Andrew J. P.; Williams, Charlotte K.","Highly Active Di- and Trimetallic Cobalt Catalysts for the Copolymerization of CHO and CO2at Atmospheric Pressure","Macromolecules","2010","43","5","2291","","10.1021/ma902582m","","","1.54184","CuKα","","0.0542","0.044","","","0.128","0.1392","","","","","","1.089","","","","has coordinates,has disorder","301775","2025-08-18","14:01:18",""
"1502787","15.597","0.003","18.542","0.003","11.201","0.002","90","","94.484","0.002","90","","3229.4","1","193","2","193","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C32 H48 B2 Ge O4 -","- C32 H48 B2 Ge O4 -","- C128 H192 B8 Ge4 O16 -","4","1","","Allard, Nicolas; Aïch, Réda Badrou; Gendron, David; Boudreault, Pierre-Luc T.; Tessier, Christian; Alem, Salima; Tse, Shing-Chi; Tao, Ye; Leclerc, Mario","Germafluorenes: New Heterocycles for Plastic Electronics","Macromolecules","2010","43","5","2328","","10.1021/ma9025866","","","0.71073","MoKα","","0.1024","0.0535","","","0.1266","0.1484","","","","","","1.083","","","","has coordinates,has disorder","301775","2025-08-18","14:01:18",""
"1502788","19.72","0.012","19.029","0.011","10.873","0.007","90","","94.88","0.009","90","","4065","4","200","2","200","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C40 H64 B2 Ge O4 -","- C40 H64 B2 Ge O4 -","- C160 H256 B8 Ge4 O16 -","4","1","","Allard, Nicolas; Aïch, Réda Badrou; Gendron, David; Boudreault, Pierre-Luc T.; Tessier, Christian; Alem, Salima; Tse, Shing-Chi; Tao, Ye; Leclerc, Mario","Germafluorenes: New Heterocycles for Plastic Electronics","Macromolecules","2010","43","5","2328","","10.1021/ma9025866","","","0.71073","MoKα","","0.1845","0.0647","","","0.1134","0.1539","","","","","","1.059","","","","has coordinates,has disorder","301775","2025-08-18","14:01:18",""
"1502789","26.407","0.013","14.346","0.007","20.052","0.01","90","","96.115","0.007","90","","7553","6","113","2","113","2","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C79 H104 Cl4 O2 Si2 Ti2 -","- C79 H104 Cl4 O2 Si2 Ti2 -","- C316 H416 Cl16 O8 Si8 Ti8 -","4","0.5","","Senda, Taichi; Hanaoka, Hidenori; Nakahara, Shinya; Oda, Yoshiaki; Tsurugi, Hayato; Mashima, Kazushi","Rational Design of Silicon-Bridged Fluorenyl−Phenoxy Group 4 Metal Complexes as Catalysts for Producing High Molecular Weight Copolymers of Ethylene and 1-Hexene at Elevated Temperature","Macromolecules","2010","43","5","2299","","10.1021/ma902700v","","","0.71075","MoKα","","0.1258","0.0808","","","0.1999","0.2475","","","","","","1.059","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1502790","9.23","0.002","10.5413","0.0019","15.742","0.003","96.051","0.005","97.568","0.011","95.234","0.009","1501.2","0.5","113","2","113","2","","","","","","","","4","P -1","-P 1","2","","","","- C34 H44 O Si -","- C34 H44 O Si -","- C68 H88 O2 Si2 -","2","1","","Senda, Taichi; Hanaoka, Hidenori; Nakahara, Shinya; Oda, Yoshiaki; Tsurugi, Hayato; Mashima, Kazushi","Rational Design of Silicon-Bridged Fluorenyl−Phenoxy Group 4 Metal Complexes as Catalysts for Producing High Molecular Weight Copolymers of Ethylene and 1-Hexene at Elevated Temperature","Macromolecules","2010","43","5","2299","","10.1021/ma902700v","","","0.71075","MoKα","","0.0663","0.0529","","","0.1357","0.1461","","","","","","1.049","","","","has coordinates","301775","2025-08-18","14:01:18",""