# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2026-03-24T15:16:55+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 'Chemistry A European Journal') AND volume = 31 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
"3000559","6.9875","0.0001","15.1552","0.0003","19.5219","0.0004","78.119","0.002","84.652","0.002","88.58","0.002","2014.18","0.07","100","2","100","2","","","","","","","","4","P -1","-P 1","2","","","","- C17.34 H18.5 N4.17 O7.5 -","- C17.337 H18.5055 N4.1685 O7.5 -","- C69.348 H74.022 N16.674 O30 -","4","2","","Gogoi, Diptajyoti; Sasaki, Toshiyuki; Kalita, Nabadeep; Sethi, Tapaswini; Ichiyanagi, Kouhei; Nakane, Takanori; Kawamoto, Akihiro; Das, Dinabandhu; Kurisu, Genji; Thakuria, Ranjit","Tuning of a Hydrogen-Bonded Organic Framework by Liquid-Assisted Mechanosynthesis between Trans-Aconitic Acid and Isonicotinamide","Chemistry A European Journal","2025","31","","e202403427(1)","e202403427(10)","10.1002/chem.202403427","","x-ray","0.812","synchrotron","","0.0694","0.0667","","","0.1886","0.1916","","","","","","1.036","","","","has coordinates,has disorder","299263","2025-04-11","08:37:10",""
"3000560","27.933","","15.206","","7.146","","90","","109.13","","90","","2867.64","","79","","79","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C12.29 H11.76 N2.29 O7.18 -","- C12.29 H11.73 N2.29 O7.19 -","- C98.32 H93.84 N18.32 O57.52 -","8","1","","Gogoi, Diptajyoti; Sasaki, Toshiyuki; Kalita, Nabadeep; Sethi, Tapaswini; Ichiyanagi, Kouhei; Nakane, Takanori; Kawamoto, Akihiro; Das, Dinabandhu; Kurisu, Genji; Thakuria, Ranjit","Tuning of a Hydrogen-Bonded Organic Framework by Liquid-Assisted Mechanosynthesis between Trans-Aconitic Acid and Isonicotinamide","Chemistry A European Journal","2025","31","","e202403427(1)","e202403427(10)","10.1002/chem.202403427","","","0.02508","electrons","","0.2584","0.1444","","","0.3735","0.409","","","","","","0.978","","","","has coordinates,has disorder","303248","2025-11-11","13:45:17",""
"3000561","7.003","","15.214","","27.473","","90","","86.94","","90","","2922.9","","79","","79","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13.75 H14 N2 O7 -","- C13.75 H14 N2 O7 -","- C110 H112 N16 O56 -","8","2","","Gogoi, Diptajyoti; Sasaki, Toshiyuki; Kalita, Nabadeep; Sethi, Tapaswini; Ichiyanagi, Kouhei; Nakane, Takanori; Kawamoto, Akihiro; Das, Dinabandhu; Kurisu, Genji; Thakuria, Ranjit","Tuning of a Hydrogen-Bonded Organic Framework by Liquid-Assisted Mechanosynthesis between Trans-Aconitic Acid and Isonicotinamide","Chemistry A European Journal","2025","31","","e202403427(1)","e202403427(10)","10.1002/chem.202403427","","","0.02508","electrons","","0.2627","0.154","","","0.3759","0.3972","","","","","","0.975","","","","has coordinates,has disorder","303248","2025-11-11","13:45:18",""
"3000562","7.507","0.019","11.44","0.03","15.4","0.04","102.48","0.03","101.82","0.03","98.28","0.05","1239","6","296","2","296","2","","","","","","","","4","P -1","-P 1","2","","","","- C43 H44 N11 O20 -","- C43 H44 N11 O20 -","- C43 H44 N11 O20 -","1","0.5","","Gogoi, Diptajyoti; Sasaki, Toshiyuki; Kalita, Nabadeep; Sethi, Tapaswini; Ichiyanagi, Kouhei; Nakane, Takanori; Kawamoto, Akihiro; Das, Dinabandhu; Kurisu, Genji; Thakuria, Ranjit","Tuning of a Hydrogen-Bonded Organic Framework by Liquid-Assisted Mechanosynthesis between Trans-Aconitic Acid and Isonicotinamide","Chemistry A European Journal","2025","31","","e202403427(1)","e202403427(10)","10.1002/chem.202403427","","","0.71073","MoKα","","0.0926","0.0801","","","0.248","0.2709","","","","","","1.056","","","","has coordinates,has disorder","297458","2025-01-24","06:20:57",""