# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-12-11T06:55:18+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 'Langmuir : the ACS journal of surfaces and colloids') AND volume = 33 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
"4514020","12.25","0.002","8.7012","0.0017","16.867","0.003","90","","102.59","0.03","90","","1754.6","0.6","293","2","293","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H16 I N3 O3 -","- C18 H16 I N3 O3 -","- C72 H64 I4 N12 O12 -","4","1","","Huang, Yaodong; Li, Huimin; Li, Ziyan; Zhang, Yan; Cao, Wenwen; Wang, Luyuan; Liu, Shuxue","Unusual C-I···O Halogen Bonding in Triazole Derivatives: Gelation Solvents at Two Extremes of Polarity and Formation of Superorganogels.","Langmuir : the ACS journal of surfaces and colloids","2017","33","1","311","321","10.1021/acs.langmuir.6b03691","","","0.71073","MoKα","","0.0424","0.0318","","","0.0997","0.1077","","","","","","1.018","","","","has coordinates","301843","2025-08-21","01:58:43",""
"4514021","24.807","0.003","5.7253","0.0008","32.699","0.004","90","","90","","90","","4644.2","1","113","2","113","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C18 H17 N3 O3 -","- C18 H17 N3 O3 -","- C216 H204 N36 O36 -","12","3","","Huang, Yaodong; Li, Huimin; Li, Ziyan; Zhang, Yan; Cao, Wenwen; Wang, Luyuan; Liu, Shuxue","Unusual C-I···O Halogen Bonding in Triazole Derivatives: Gelation Solvents at Two Extremes of Polarity and Formation of Superorganogels.","Langmuir : the ACS journal of surfaces and colloids","2017","33","1","311","321","10.1021/acs.langmuir.6b03691","","","0.71073","MoKα","","0.0428","0.0377","","","0.0989","0.1032","","","","","","1.027","","","","has coordinates","301843","2025-08-21","01:58:43",""
"4514171","5.014","0.001","11.531","0.002","18.198","0.004","90.266","0.005","95.463","0.004","90.212","0.005","1047.3","0.4","296","2","296","2","","","","","","","","4","P 1","P 1","1","","","","- C22 H28 N2 O4 -","- C22 H28 N2 O4 -","- C44 H56 N4 O8 -","2","2","","Misra, Rajkumar; Sharma, Aman; Shiras, Anjali; Gopi, Hosahudya N.","Backbone Engineered γ-Peptide Amphitropic Gels for Immobilization of Semiconductor Quantum Dots and 2D Cell Culture.","Langmuir : the ACS journal of surfaces and colloids","2017","33","31","7762","7768","10.1021/acs.langmuir.7b01283","","","0.71073","MoKα","","0.0575","0.0448","","","0.1336","0.1519","","","","","","0.787","","","","has coordinates","200719","2020-10-21","18:00:00",""
"4514192","5.172","0.008","27.15","0.04","9.752","0.014","90","","95.2","0.03","90","","1364","4","296","2","296","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C29 H38 N2 O5 -","- C29 H40 N2 O5 -","- C58 H80 N4 O10 -","2","1","","Misra, Rajkumar; Sharma, Aman; Shiras, Anjali; Gopi, Hosahudya N.","Backbone Engineered γ-Peptide Amphitropic Gels for Immobilization of Semiconductor Quantum Dots and 2D Cell Culture.","Langmuir : the ACS journal of surfaces and colloids","2017","33","31","7762","7768","10.1021/acs.langmuir.7b01283","","","0.71073","MoKα","","0.1692","0.071","","","0.1549","0.2142","","","","","","0.898","","","","has coordinates","200482","2020-10-21","18:00:00",""