# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T11:09:39+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 'Molecules (Basel, Switzerland)') AND volume = 26 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
"1560281","8.6034","0.0002","9.0805","0.0002","16.4248","0.0004","99.579","0.002","94.035","0.002","108.412","0.002","1190.09","0.05","93","2","93","2","","","","","","","","7","P -1","-P 1","2","","","","- C21 H27 B F2 I N3 O5 -","- C21 H27 B F2 I N3 O5 -","- C42 H54 B2 F4 I2 N6 O10 -","2","1","","Kuno, Atsuko; Maeda, Hiromitsu","Nitro-Substituted Dipyrrolyldiketone BF<sub>2</sub> Complexes as Electronic-State-Adjustable Anion-Responsive π-Electronic Systems.","Molecules (Basel, Switzerland)","2021","26","3","595","","10.3390/molecules26030595","","","1.54184","CuKα","","0.0778","0.076","","","0.219","0.2207","","","","","","1.05","","","","has coordinates,has disorder","261790","2021-02-05","09:48:06",""
"1560282","11.2903","0.0001","22.2353","0.0002","16.8402","0.0001","90","","98.74","0.001","90","","4178.53","0.06","93","2","93","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C19 H23 B F2 I N3 O4 -","- C19 H23 B F2 I N3 O4 -","- C152 H184 B8 F16 I8 N24 O32 -","8","2","","Kuno, Atsuko; Maeda, Hiromitsu","Nitro-Substituted Dipyrrolyldiketone BF<sub>2</sub> Complexes as Electronic-State-Adjustable Anion-Responsive π-Electronic Systems.","Molecules (Basel, Switzerland)","2021","26","3","595","","10.3390/molecules26030595","","","1.54184","CuKα","","0.0327","0.031","","","0.0839","0.0849","","","","","","1.034","","","","has coordinates","261790","2021-02-05","09:48:07",""
"1560837","10.852","0.002","25.406","0.005","12.801","0.002","90","","109.74","0.03","90","","3321.9","1.2","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C62 H56 Co3 N8 O16 S6 -","- C62 H56 Co3 N8 O16 S6 -","- C124 H112 Co6 N16 O32 S12 -","2","0.5","","Dubskikh, Vadim A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P.","3D Metal-Organic Frameworks Based on Co(II) and Bithiophendicarboxylate: Synthesis, Crystal Structures, Gas Adsorption, and Magnetic Properties.","Molecules (Basel, Switzerland)","2021","26","5","1269","","10.3390/molecules26051269","","","0.79313","synchrotron","","0.0575","0.0506","","","0.1375","0.1429","","","","","","1.052","","","","has coordinates,has disorder","262759","2021-03-05","13:37:07",""
"1560838","11.96","0.02","25.867","0.008","11.461","0.016","90","","106.49","0.03","90","","3400","7","100","2","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C48 H58 Co3 N6 O20 S6 -","- C42 H40 Co3 N4 O16 S6 -","- C84 H80 Co6 N8 O32 S12 -","2","0.5","","Dubskikh, Vadim A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P.","3D Metal-Organic Frameworks Based on Co(II) and Bithiophendicarboxylate: Synthesis, Crystal Structures, Gas Adsorption, and Magnetic Properties.","Molecules (Basel, Switzerland)","2021","26","5","1269","","10.3390/molecules26051269","","","0.79313","synchrotron","","0.117","0.0762","","","0.2142","0.2365","","","","","","1.044","","","","has coordinates,has disorder","262760","2021-03-05","13:37:51",""
"1560839","11.746","0.002","42.15","0.004","51.849","0.002","90","","90","","90","","25670","5","100","2","100","2","","","","","","","","6","F d d d :2","-F 2uv 2vw","70","","","","- C52 H61 Co3 N8 O19.5 S6 -","- C40 H30 Co3 N4 O14 S6 -","- C640 H480 Co48 N64 O224 S96 -","16","0.5","","Dubskikh, Vadim A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P.","3D Metal-Organic Frameworks Based on Co(II) and Bithiophendicarboxylate: Synthesis, Crystal Structures, Gas Adsorption, and Magnetic Properties.","Molecules (Basel, Switzerland)","2021","26","5","1269","","10.3390/molecules26051269","","","0.79313","synchrotron","","0.0442","0.0361","","","0.0961","0.0997","","","","","","1.073","","","","has coordinates","262761","2021-03-05","13:38:28",""