# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-16T12:36:24+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 'Journal of the American Chemical Society') AND volume = 109 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
"1100289","9.191","0.001","16.567","0.002","11.465","0.004","90","","101.93","0.02","90","","1708.04","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C20 H19 N O3 -","- C20 H19 N O3 -","- C80 H76 N4 O12 -","4","2","","Tietze, Lutz F.; Brand, Siegbert; Pfeiffer, Thomas; Antel, Jochen; Harms, Klaus; Sheldrick, George M.","Intra- and intermolecular hetero-Diels-Alder reactions. 15. Asymmetric induction in Grignard and hetero-Diels-Alder reactions of chiral α,β-unsaturated carbonyl compounds","Journal of the American Chemical Society","1987","109","3","921","923","10.1021/ja00237a060","","","","","","","","","","","","","","","","","","","","","has coordinates","177985","2020-10-21","18:00:00",""
"4119072","18.672","","14.026","","9.731","","90","","90","","90","","2548.49","","","","","","","","","","","","","5","P m m a","-P 2a 2a","51","","Cs K Zr6 Cl15 B","","- B Cl15 Cs K Zr6 -","- B0.995 Cl15 Cs K Zr6 -","- B3.98 Cl60 Cs4 K4 Zr24 -","4","0.5","","Corbett, J.D.; Ziebarth, R.P.","Cation distributions within a cluster framework. Synthesis and structure of the carbon- and boron-centered zirconium cluster compounds Cs K Zr6 Cl15 C and Cs K Zr6 Cl15 B","Journal of the American Chemical Society","1987","109","","4844","4850","10.1021/ja00250a015","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4124438","12.252","","12.252","","12.252","","90","","90","","90","","1839.17","","","","","","","","","","","","","5","P m -3 m","-P 4 2 3","221","","Cs9.08 Na3.52 (Al12 Si12 O48)","","- Al12 Cs9.08 Na3.52 O48 Si12 -","- Al12 Cs9.08 Na3.52 O48 Si12 -","- Al12 Cs9.08 Na3.52 O48 Si12 -","1","0.0208333","","Heo, N.-H.; Seff, K.","Reaction of dehydrated Na12-A with cesium. Synthesis and crystal structure of fully dehydrated, fully Cs+ -exchanged Zeolite A","Journal of the American Chemical Society","1987","109","","7986","7992","","","","","","","","","","","","","","","","","","","","","","has coordinates","155049","2020-10-21","18:00:00",""
"4124439","12.279","","12.279","","12.279","","90","","90","","90","","1851.35","","","","","","","","","","","","","4","P m -3 m","-P 4 2 3","221","","Cs12.48 (Al12 Si12 O48)","","- Al12 Cs12.48 O48 Si12 -","- Al12 Cs12.48 O48 Si12 -","- Al12 Cs12.48 O48 Si12 -","1","0.0208333","","Heo, N.-H.; Seff, K.","Reaction of dehydrated Na12-A with cesium. Synthesis and crystal structure of fully dehydrated, fully Cs+ -exchanged Zeolite A","Journal of the American Chemical Society","1987","109","","7986","7992","","","","","","","","","","","","","","","","","","","","","","has coordinates","155050","2020-10-21","18:00:00",""
"4124452","11.774","","11.774","","11.774","","90","","90","","90","","1632.19","","","","","","","","","","","","","4","P m -3 n","-P 4n 2 3","223","","H (P F6) (H2 O)7.67","","- F6 H16.34 O7.67 P -","- F6 H15.3333 O7.66667 P -","- F36 H92 O46 P6 -","6","0.125","","Mootz, D.; Oellers, E.J.; Wiebcke, M.","First examples of type I clathrate hydrates of strong acids: Polyhydrates of hexafluorophosphoric, tetrafluoroboric, and perchloric acid","Journal of the American Chemical Society","1987","109","","1200","1202","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4124474","18.489","","13.909","","9.69","","90","","90","","90","","2491.91","","","","","","","","","","","","","4","P m m a","-P 2a 2a","51","","K Zr6 Cl15 C","","- C Cl15 K Zr6 -","- C Cl15 K Zr6 -","- C4 Cl60 K4 Zr24 -","4","0.5","","Ziebarth, R.P.; Corbett, J.D.","Cation distributions within a cluster framework. Synthesis and structure of the carbon- and boron-centered zirconium cluster compounds K Zr6 C15 C and Cs K Zr6 Cl15 B","Journal of the American Chemical Society","1987","109","","4844","4850","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""