# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-04-21T09:50:35+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 'Organic Process Research & Development') AND volume = 13 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
"1504315","9.0929","0.0009","12.3452","0.0012","22.031","0.002","90","","90","","90","","2473.1","0.4","294","2","294","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C28 H25 N3 O5 S -","- C28 H25 N3 O5 S -","- C112 H100 N12 O20 S4 -","4","1","","Roy, Bhairab Nath; Singh, Girij Pal; Srivastava, Dhananjai; Jadhav, Harishchandra S.; Saini, Manmeet B.; Aher, Umesh P.","A Novel Method for Large-Scale Synthesis of Lamivudine through Cocrystal Formation of Racemic Lamivudine with (S)-(−)-1,1′-Bi(2-naphthol) [(S)-(BINOL)]","Organic Process Research & Development","2009","13","3","450","","10.1021/op800228h","","","0.71073","MoKα","","0.0321","0.0292","","","0.077","0.0798","","","","","","1.052","","","","has coordinates","301775","2025-08-18","14:01:20",""
"1504316","16.163","0.01","8.953","0.005","22.95","0.014","90","","90","","90","","3321","3","108","2","108","2","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C9 H9 N O3 -","- C9 H9 N O3 -","- C144 H144 N16 O48 -","16","2","","Hansen, Marvin M.; Borders, Sandra S. K.; Clayton, Marcella T.; Heath, Perry C.; Kolis, Stanley P.; Larsen, Samuel D.; Linder, Ryan J.; Reutzel-Edens, Susan M.; Smith, Justin C.; Tameze, Shella L.; Ward, Jeffrey A.; Weigel, Leland O.","Development of a Practical Synthesis of an Aminoindanol-Derived M1 Agonist†","Organic Process Research & Development","2009","13","2","198","","10.1021/op800243q","","","0.71073","MoKα","","0.0974","0.0452","","","0.1007","0.1176","","","","","","0.963","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1504317","16.038","0.012","14.67","0.011","15.634","0.012","90","","116.362","0.011","90","","3296","4","105","2","105","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C9 H9 N O3 -","- C9 H9 N O3 -","- C144 H144 N16 O48 -","16","2","","Hansen, Marvin M.; Borders, Sandra S. K.; Clayton, Marcella T.; Heath, Perry C.; Kolis, Stanley P.; Larsen, Samuel D.; Linder, Ryan J.; Reutzel-Edens, Susan M.; Smith, Justin C.; Tameze, Shella L.; Ward, Jeffrey A.; Weigel, Leland O.","Development of a Practical Synthesis of an Aminoindanol-Derived M1 Agonist†","Organic Process Research & Development","2009","13","2","198","","10.1021/op800243q","","","0.71073","MoKα","","0.2507","0.0821","","","0.1425","0.1793","","","","","","0.884","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1504318","6.0017","0.0002","12.0689","0.0003","29.9339","0.0008","90","","90","","90","","2168.23","0.11","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C21 H33 N O7 S -","- C21 H33 N O7 S -","- C84 H132 N4 O28 S4 -","4","1","","Kopach, Michael E.; Singh, Utpal K.; Kobierski, Michael E.; Trankle, William G.; Murray, Michael M.; Pietz, Mark A.; Forst, Mindy B.; Stephenson, Gregory A.; Mancuso, Vincent; Giard, Thierry; Vanmarsenille, Michel; DeFrance, Thierry","Practical Synthesis of Chiral 2-Morpholine: (4-Benzylmorpholin-2-(S)-yl)-(tetrahydropyran-4-yl)methanone Mesylate, a Useful Pharmaceutical Intermediate","Organic Process Research & Development","2009","13","2","209","","10.1021/op800247w","","","1.54178","CuKα","","0.0781","0.0608","","","0.165","0.1737","","","","","","1.065","","","","has coordinates","301775","2025-08-18","14:01:20",""
"1504319","9.4251","0.0002","9.2575","0.0002","20.1686","0.0005","90","","90","","90","","1759.77","0.07","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","para-Chloropropionanilide","","","- C9 H10 Cl N O -","- C9 H10 Cl N O -","- C72 H80 Cl8 N8 O8 -","8","1","","Hursthouse, Michael B.; Huth, L. Susanne; Threlfall, Terence L.","Why Do Organic Compounds Crystallise Well or Badly or Ever so Slowly? Why Is Crystallisation Nevertheless Such a Good Purification Technique?†","Organic Process Research & Development","2009","13","6","1231","","10.1021/op900169b","","","0.71073","MoKα","","0.0428","0.0372","","","0.0863","0.0905","","","","","","1.054","","","","has coordinates","301775","2025-08-18","14:01:20",""
"1504320","9.7381","0.0002","10.0151","0.0001","22.9501","0.0004","90","","90","","90","","2238.28","0.06","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","para-Chloro-t-butylanilide","","","- C11 H14 Cl N O -","- C11 H14 Cl N O -","- C88 H112 Cl8 N8 O8 -","8","1","","Hursthouse, Michael B.; Huth, L. Susanne; Threlfall, Terence L.","Why Do Organic Compounds Crystallise Well or Badly or Ever so Slowly? Why Is Crystallisation Nevertheless Such a Good Purification Technique?†","Organic Process Research & Development","2009","13","6","1231","","10.1021/op900169b","","","0.71073","MoKα","","0.0401","0.0331","","","0.0812","0.0859","","","","","","1.023","","","","has coordinates","301775","2025-08-18","14:01:20",""
"1504321","42.887","0.005","5.1367","0.0005","19.263","0.003","90","","108.372","0.005","90","","4027.3","0.9","120","2","120","2","","","","","","","","4","C 1 2/c 1","-C 2yc","15","para-Methylbutyranilide","","","- C11 H15 N O -","- C11 H15 N O -","- C176 H240 N16 O16 -","16","2","","Hursthouse, Michael B.; Huth, L. Susanne; Threlfall, Terence L.","Why Do Organic Compounds Crystallise Well or Badly or Ever so Slowly? Why Is Crystallisation Nevertheless Such a Good Purification Technique?†","Organic Process Research & Development","2009","13","6","1231","","10.1021/op900169b","","","0.71073","MoKα","","0.2225","0.1191","","","0.2299","0.2771","","","","","","1.045","","","","has coordinates","301775","2025-08-18","14:01:20",""
"1504322","9.1595","0.0008","11.8459","0.001","6.6063","0.0005","90","","93.952","0.006","90","","715.1","0.1","120","2","120","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","meta-Bromoformanilide","","","- C7 H6 Br N O -","- C7 H6 Br N O -","- C28 H24 Br4 N4 O4 -","4","1","","Hursthouse, Michael B.; Huth, L. Susanne; Threlfall, Terence L.","Why Do Organic Compounds Crystallise Well or Badly or Ever so Slowly? Why Is Crystallisation Nevertheless Such a Good Purification Technique?†","Organic Process Research & Development","2009","13","6","1231","","10.1021/op900169b","","","0.71073","MoKα","","0.0476","0.0401","","","0.0982","0.1023","","","","","","1.066","","","","has coordinates","301775","2025-08-18","14:01:20",""
"1504323","10.848","0.0004","9.8017","0.0003","13.5375","0.0004","90","","90","","90","","1439.43","0.08","120","2","120","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","para-Bromoformanilide","","","- C7 H6 Br N O -","- C7 H6 Br N O -","- C56 H48 Br8 N8 O8 -","8","1","","Hursthouse, Michael B.; Huth, L. Susanne; Threlfall, Terence L.","Why Do Organic Compounds Crystallise Well or Badly or Ever so Slowly? Why Is Crystallisation Nevertheless Such a Good Purification Technique?†","Organic Process Research & Development","2009","13","6","1231","","10.1021/op900169b","","","0.71073","MoKα","","0.0326","0.0255","","","0.0614","0.0668","","","","","","0.986","","","","has coordinates","301775","2025-08-18","14:01:20",""
"1504324","7.1142","0.0003","10.3129","0.0006","12.2349","0.0008","77.686","0.003","79.631","0.004","70.525","0.004","821.03","0.08","120","2","120","2","","","","","","","","5","P -1","-P 1","2","para-Trifluoromethylformanilide","","","- C8 H6 F3 N O -","- C8 H6 F3 N O -","- C32 H24 F12 N4 O4 -","4","2","","Hursthouse, Michael B.; Huth, L. Susanne; Threlfall, Terence L.","Why Do Organic Compounds Crystallise Well or Badly or Ever so Slowly? Why Is Crystallisation Nevertheless Such a Good Purification Technique?†","Organic Process Research & Development","2009","13","6","1231","","10.1021/op900169b","","","0.71073","MoKα","","0.1004","0.0577","","","0.1384","0.1617","","","","","","1.01","","","","has coordinates,has disorder","301775","2025-08-18","14:01:20",""