# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-03T03:45:25+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 Chemical Society B: Physical Organic') 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
"1513335","8.233","0.001","10.07","0.002","14.865","0.002","90","","102.53","0.02","90","","1203","0.3","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","N-(alpha-Glutarimido)-phthalimide","Thalidomide","","- C13 H10 N2 O4 -","- C13 H10 N2 O4 -","- C52 H40 N8 O16 -","4","1","","Allen, F. H.; Trotter, J.","Crystal and molecular structure of thalidomide, N-(α-glutarimido)-phthalimide","Journal of the Chemical Society B: Physical Organic","1971","","","1073","1079","10.1039/J29710001073","","","","","","","0.053","","","0.053","","","","","","","","","","","has coordinates","176428","2020-10-21","18:00:00",""
"5000283","15.454","0.005","6.547","0.003","11.425","0.004","90","","121.27","0.03","90","","988.03","","","","","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C9 H11 N O6 -","- C9 H10 N O6 -","- C36 H40 N4 O24 -","4","1","","Tsukuda, Y.; Koyama, H.","Crystal and molecular structure of showdomycin","Journal of the Chemical Society B: Physical Organic","1970","","","1709","1712","10.1039/J29700001709","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""