# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-29T12:22:44+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 'J. Mater. Chem. B') 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
"7235867","21.86","0.02","16.453","0.016","7.184","0.007","90","","97.643","0.011","90","","2561","4","296","2","296","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C54 H62 Cu O14 -","- C54 H62 Cu O14 -","- C108 H124 Cu2 O28 -","2","0.5","","Xu, Guoyong; Wang, Jiafeng; Liu, Tao; Wang, Mahong; Zhou, Shuangsheng; Wu, Baoxing; Jiang, Minghua","Synthesis and crystal structure of a novel copper(ii) complex of curcumin-type and its application in in vitro and in vivo imaging","J. Mater. Chem. B","2014","2","23","3659","","10.1039/C4TB00133H","","","0.71073","MoKα","","0.0629","0.0503","","","0.142","0.1557","","","","","","1.095","","","","has coordinates","233392","2020-10-21","18:00:00",""
"7235869","12.0614","0.001","12.2502","0.001","14.7645","0.0013","87.449","0.007","85.384","0.007","72.203","0.007","2069.9","0.3","298","2","298","2","","","","","","","","5","P -1","-P 1","2","","","","- C51 H36 Cl2 N4 O2 -","- C51 H36 Cl2 N4 O2 -","- C102 H72 Cl4 N8 O4 -","2","1","","Zhang, Ying; Wang, Jun-Hao; Zheng, Wenjie; Chen, Tianfeng; Tong, Qing-Xiao; Li, Dan","An ESIPT fluorescent dye based on HBI with high quantum yield and large Stokes shift for selective detection of Cys","J. Mater. Chem. B","2014","2","26","4159","","10.1039/C4TB00190G","","","1.54184","CuKα","","0.0832","0.072","","","0.2514","0.2817","","","","","","1","","","","has coordinates","233396","2020-10-21","18:00:00",""
"7235870","10.4162","0.0008","11.3223","0.0008","11.4154","0.0008","117.225","0.001","102.711","0.001","91.607","0.001","1154.87","0.15","123","2","123","2","","","","","","","","3","P -1","-P 1","2","","","","- C28 H22 N6 -","- C28 H22 N6 -","- C56 H44 N12 -","2","1","","Liang, Jing; Shi, Haibin; Kwok, Ryan T. K.; Gao, Meng; Yuan, Youyong; Zhang, Wenhua; Tang, Ben Zhong; Liu, Bin","Distinct optical and kinetic responses from E/Z isomers of caspase probes with aggregation-induced emission characteristics","J. Mater. Chem. B","2014","2","27","4363","","10.1039/C4TB00405A","","","0.71073","MoKα","","0.0731","0.0629","","","0.1546","0.1637","","","","","","0.988","","","","has coordinates,has disorder","233397","2020-10-21","18:00:00",""
"7235871","11.899","0.005","12.656","0.005","18.797","0.005","85.623","0.005","74.828","0.005","87.564","0.005","2723.3","1.7","291","2","291","2","","","","","","","","4","P -1","-P 1","2","","","","- C62 H54 N6 O8 -","- C62 H54 N6 O8 -","- C124 H108 N12 O16 -","2","1","","Liu, Yanqiu; Kong, Ming; Zhang, Qiong; Zhang, Zhiwen; Zhou, Hongping; Zhang, Shengyi; Li, Shengli; Wu, Jieying; Tian, Yupeng","A series of triphenylamine-based two-photon absorbing materials with AIE property for biological imaging","J. Mater. Chem. B","2014","2","33","5430","","10.1039/C4TB00464G","","","0.71069","MoKα","","0.1274","0.0764","","","0.2228","0.264","","","","","","1.046","","","","has coordinates,has disorder","233399","2020-10-21","18:00:00",""
"7235872","10.717","0.005","13.917","0.005","17.565","0.005","90","0.005","92.417","0.005","90","0.005","2617.5","1.7","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H29 N3 O2 -","- C31 H29 N3 O2 -","- C124 H116 N12 O8 -","4","1","","Liu, Yanqiu; Kong, Ming; Zhang, Qiong; Zhang, Zhiwen; Zhou, Hongping; Zhang, Shengyi; Li, Shengli; Wu, Jieying; Tian, Yupeng","A series of triphenylamine-based two-photon absorbing materials with AIE property for biological imaging","J. Mater. Chem. B","2014","2","33","5430","","10.1039/C4TB00464G","","","0.71069","MoKα","","0.1023","0.0506","","","0.139","0.1797","","","","","","1.005","","","","has coordinates","233399","2020-10-21","18:00:00",""
"7235873","10.326","0.005","22.629","0.005","12.174","0.005","90","0.005","114.636","0.005","90","0.005","2585.7","1.7","291","2","291","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H28 N2 O4 -","- C30 H28 N2 O4 -","- C120 H112 N8 O16 -","4","1","","Liu, Yanqiu; Kong, Ming; Zhang, Qiong; Zhang, Zhiwen; Zhou, Hongping; Zhang, Shengyi; Li, Shengli; Wu, Jieying; Tian, Yupeng","A series of triphenylamine-based two-photon absorbing materials with AIE property for biological imaging","J. Mater. Chem. B","2014","2","33","5430","","10.1039/C4TB00464G","","","0.71069","MoKα","","0.1583","0.0688","","","0.1895","0.2322","","","","","","1.072","","","","has coordinates,has disorder","233401","2020-10-21","18:00:00",""
"7235874","10.0878","0.0014","12.7641","0.0016","28.139","0.004","90","","90","","90","","3623.2","0.9","293","2","293","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C20 H0 N6 O0.13 S -","- C20 H16 N2 O4 S -","- C160 H128 N16 O32 S8 -","8","1","","Zhao, Xuan-Xuan; Zhang, Jin-Feng; Liu, Wei; Zhou, Shuai; Zhou, Ze-Quan; Xiao, Yu-Hao; Xi, Gang; Miao, Jun-Ying; Zhao, Bao-Xiang","A unique dansyl-based chromogenic chemosensor for rapid and ultrasensitive hydrazine detection","J. Mater. Chem. B","2014","2","42","7344","","10.1039/C4TB01192A","","","0.71073","MOKα","","0.0791","0.0448","","","0.1041","0.1197","","","","","","1.039","","","","has coordinates","233403","2020-10-21","18:00:00",""
"7236697","13.1267","0.0004","3.8689","0.0001","12.781","0.0004","90","","93.945","0.001","90","","647.56","0.03","100","2","100","2","","","","","","","","3","P 1 c 1","P -2yc","7","","","","- C17 H12 O4 -","- C17 H12 O4 -","- C34 H24 O8 -","2","1","","Ji, Wei; Li, Lingling; Eniola-Adefeso, Omolola; Wang, Yaming; Liu, Chuntai; Feng, Chuanliang","Non-invasively visualizing cell‒matrix interactions in two-photon excited supramolecular hydrogels","J. Mater. Chem. B","2017","5","38","7790","","10.1039/C7TB02274C","","","1.54178","CuKα","","0.0372","0.0371","","","0.1055","0.1057","","","","","","1.069","","","","has coordinates","236439","2020-10-21","18:00:00",""
"7236698","6.649","0.0005","28.779","0.002","7.22","0.0006","90","","115.909","0.003","90","","1242.7","0.17","298","2","298","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C16 H10 O4 -","- C16 H10 O4 -","- C64 H40 O16 -","4","1","","Ji, Wei; Li, Lingling; Eniola-Adefeso, Omolola; Wang, Yaming; Liu, Chuntai; Feng, Chuanliang","Non-invasively visualizing cell‒matrix interactions in two-photon excited supramolecular hydrogels","J. Mater. Chem. B","2017","5","38","7790","","10.1039/C7TB02274C","","","1.54178","CuKα","","0.0423","0.0355","","","0.1046","0.111","","","","","","1.05","","","","has coordinates","236439","2020-10-21","18:00:00",""
"7239582","20.9534","0.0017","15.4403","0.0012","29.153","0.002","90","","96.57","0.002","90","","9369.8","1.2","100","0.1","100","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C46.5 H50 Cl2.5 N4 O8.5 Ru2 -","- C45.5 H46 Cl2.5 N4 O9 Ru2 -","- C364 H368 Cl20 N32 O72 Ru16 -","8","2","","Rojas, S.; Quartapelle-Procopio, E.; Carmona, F. J.; Romero, M. A.; Navarro, J. A. R.; Barea, E.","Biophysical characterisation, antitumor activity and MOF encapsulation of a half-sandwich ruthenium(ii) mitoxantronato system","J. Mater. Chem. B","2014","2","17","2473","","10.1039/C3TB21455A","","","0.71073","MoKα","","0.1666","0.0908","","","0.2134","0.2766","","","","","","1.039","","","","has coordinates","244778","2020-10-21","18:00:00",""
"7239583","11.7757","0.0005","11.5358","0.0005","16.1129","0.0007","90","","94.112","0.002","90","","2183.18","0.16","147","2","147","2","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C20 H30 Br N3 O2 S -","- C20 H30 Br N3 O2 S -","- C80 H120 Br4 N12 O8 S4 -","4","1","","Porosa, Lukasz M.; Mistry, Kamlesh B.; Mocella, Amanda; Deng, Hellen; Hamzehi, Shayan; Caschera, Alex; Lough, Alan J.; Wolfaardt, Gideon; Foucher, Daniel A.","Synthesis, structures and properties of self-assembling quaternary ammonium dansyl fluorescent tags for porous and non-porous surfaces","J. Mater. Chem. B","2014","2","11","1509","","10.1039/C3TB21633K","","","1.54178","CuKα","","0.0282","0.0248","","","0.0632","0.0652","","","","","","1.051","","","","has coordinates","244779","2020-10-21","18:00:00",""
"7239584","10.5518","0.0003","12.7906","0.0003","13.4228","0.0004","90","","101.582","0.0013","90","","1774.71","0.08","150","1","150","1","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C17 H25 N3 O2 S -","- C17 H25 N3 O2 S -","- C68 H100 N12 O8 S4 -","4","1","","Porosa, Lukasz M.; Mistry, Kamlesh B.; Mocella, Amanda; Deng, Hellen; Hamzehi, Shayan; Caschera, Alex; Lough, Alan J.; Wolfaardt, Gideon; Foucher, Daniel A.","Synthesis, structures and properties of self-assembling quaternary ammonium dansyl fluorescent tags for porous and non-porous surfaces","J. Mater. Chem. B","2014","2","11","1509","","10.1039/C3TB21633K","","","0.71073","MoKα","","0.0938","0.0551","","","0.1321","0.1567","","","","","","1.056","","","","has coordinates","244779","2020-10-21","18:00:00",""