# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-28T10:35:57+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 'Journal of Materials Chemistry B') AND volume = 3 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
"7236145","15.4537","0.0014","9.1572","0.0008","43.467","0.004","90","","92.602","0.004","90","","6144.8","1","173.15","","173.15","","","","","","","","","5","I 1 2/a 1","-I 2ya","15","","","","- C32 H37 Cl N3 O5 -","- C32 H37 Cl N3 O5 -","- C256 H296 Cl8 N24 O40 -","8","1","","Majumder, Joydeb; Deb, Jolly; Husain, Ahmad; Jana, Siddhartha Sankar; Dastidar, Parthasarathi","Cetirizine derived supramolecular topical gel in action: rational design, characterization and in vivo self-delivery application in treating skin allergy in mice","Journal of Materials Chemistry B","2015","3","32","6634","","10.1039/C5TB00676G","","","0.71073","MoKα","","0.1662","0.0937","","","0.2513","0.2803","","","","","","1.04","","","","has coordinates,has disorder","233962","2020-10-21","18:00:00",""
"7236146","10.9","0.011","11.786","0.012","24.64","0.03","102.078","0.012","90.025","0.013","113.655","0.012","2823","5","100","2","100.15","","","","","","","","","5","P -1","-P 1","2","","","","- C50 H82 Cl2 N6 O17 -","- C50 H82 Cl2 N6 O17 -","- C100 H164 Cl4 N12 O34 -","2","1","","Majumder, Joydeb; Deb, Jolly; Husain, Ahmad; Jana, Siddhartha Sankar; Dastidar, Parthasarathi","Cetirizine derived supramolecular topical gel in action: rational design, characterization and in vivo self-delivery application in treating skin allergy in mice","Journal of Materials Chemistry B","2015","3","32","6634","","10.1039/C5TB00676G","","","0.71073","MoKα","","0.1915","0.0741","","","0.1572","0.1891","","","","","","0.924","","","","has coordinates,has disorder","233962","2020-10-21","18:00:00",""
"7236147","19.7987","0.0004","10.3272","0.0003","27.5213","0.0004","90","","95.515","0.001","90","","5601.1","0.2","293","2","293","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C26 H36 N4 O4 Sn -","- C26 H36 N4 O4 Sn -","- C208 H288 N32 O32 Sn8 -","8","1","","Jiménez-Pérez, Víctor M.; García-López, María C.; Muñoz-Flores, Blanca M.; Chan-Navarro, Rodrigo; Berrones-Reyes, Jessica C.; Dias, H. V. Rasika; Moggio, Ivana; Arias, Eduardo; Serrano-Mireles, Jesús A.; Chavez-Reyes, Arturo","New application of fluorescent organotin compounds derived from Schiff bases: synthesis, X-ray structures, photophysical properties, cytotoxicity and fluorescent bioimaging","Journal of Materials Chemistry B","2015","3","28","5731","","10.1039/C5TB00717H","","","0.71073","MoKα","","0.0892","0.055","","","0.1315","0.1511","","","","","","1.019","","","","has coordinates","233965","2020-10-21","18:00:00",""
"7236148","8.6061","0.0002","11.9693","0.0002","12.7463","0.0002","105.872","0.001","91.998","0.001","95.725","0.001","1253.97","0.04","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C27 H21 N3 O5 Sn -","- C27 H21 N3 O5 Sn -","- C54 H42 N6 O10 Sn2 -","2","1","","Jiménez-Pérez, Víctor M.; García-López, María C.; Muñoz-Flores, Blanca M.; Chan-Navarro, Rodrigo; Berrones-Reyes, Jessica C.; Dias, H. V. Rasika; Moggio, Ivana; Arias, Eduardo; Serrano-Mireles, Jesús A.; Chavez-Reyes, Arturo","New application of fluorescent organotin compounds derived from Schiff bases: synthesis, X-ray structures, photophysical properties, cytotoxicity and fluorescent bioimaging","Journal of Materials Chemistry B","2015","3","28","5731","","10.1039/C5TB00717H","","","0.71073","MoKα","","0.0469","0.0365","","","0.0972","0.1035","","","","","","1.225","","","","has coordinates","233965","2020-10-21","18:00:00",""
"7236149","9.845","0.0012","8.6454","0.001","28.744","0.003","90","","93.078","0.001","90","","2443","0.5","100","2","100.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C30 H22 N2 O2 Sn -","- C30 H22 N2 O2 Sn -","- C120 H88 N8 O8 Sn4 -","4","1","","Jiménez-Pérez, Víctor M.; García-López, María C.; Muñoz-Flores, Blanca M.; Chan-Navarro, Rodrigo; Berrones-Reyes, Jessica C.; Dias, H. V. Rasika; Moggio, Ivana; Arias, Eduardo; Serrano-Mireles, Jesús A.; Chavez-Reyes, Arturo","New application of fluorescent organotin compounds derived from Schiff bases: synthesis, X-ray structures, photophysical properties, cytotoxicity and fluorescent bioimaging","Journal of Materials Chemistry B","2015","3","28","5731","","10.1039/C5TB00717H","","","0.71073","MoKα","","0.031","0.0287","","","0.073","0.0748","","","","","","1.065","","","","has coordinates","233965","2020-10-21","18:00:00",""
"7236150","11.1871","0.0013","15.2135","0.0018","17.015","0.002","109.408","0.001","98.162","0.001","110.771","0.001","2440.4","0.5","100","2","100.15","","","","","","","","","5","P -1","-P 1","2","","","","- C26 H29 N3 O4 Sn -","- C26 H29 N3 O4 Sn -","- C104 H116 N12 O16 Sn4 -","4","2","","Jiménez-Pérez, Víctor M.; García-López, María C.; Muñoz-Flores, Blanca M.; Chan-Navarro, Rodrigo; Berrones-Reyes, Jessica C.; Dias, H. V. Rasika; Moggio, Ivana; Arias, Eduardo; Serrano-Mireles, Jesús A.; Chavez-Reyes, Arturo","New application of fluorescent organotin compounds derived from Schiff bases: synthesis, X-ray structures, photophysical properties, cytotoxicity and fluorescent bioimaging","Journal of Materials Chemistry B","2015","3","28","5731","","10.1039/C5TB00717H","","","0.71073","MoKα","","0.052","0.0407","","","0.0976","0.1046","","","","","","1.039","","","","has coordinates","233965","2020-10-21","18:00:00",""
"7236151","9.9567","0.0018","10.633","0.002","12.581","0.002","111.606","0.002","93.531","0.002","93.129","0.002","1231.7","0.4","100","2","100.15","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H21 N3 O4 Sn -","- C30 H21 N3 O4 Sn -","- C60 H42 N6 O8 Sn2 -","2","1","","Jiménez-Pérez, Víctor M.; García-López, María C.; Muñoz-Flores, Blanca M.; Chan-Navarro, Rodrigo; Berrones-Reyes, Jessica C.; Dias, H. V. Rasika; Moggio, Ivana; Arias, Eduardo; Serrano-Mireles, Jesús A.; Chavez-Reyes, Arturo","New application of fluorescent organotin compounds derived from Schiff bases: synthesis, X-ray structures, photophysical properties, cytotoxicity and fluorescent bioimaging","Journal of Materials Chemistry B","2015","3","28","5731","","10.1039/C5TB00717H","","","0.71073","MoKα","","0.0566","0.0457","","","0.1025","0.1085","","","","","","1.013","","","","has coordinates","233965","2020-10-21","18:00:00",""
"7236152","19.299","0.005","16.646","0.005","16.423","0.005","90","0.005","103.904","0.005","90","0.005","5121","3","298","2","298","2","","","","","","","","7","P 1 21/c 1","-P 2ybc","14","","","","- C50 H46 F12 N6 P2 S2 Zn -","- C50 H46 F12 N6 P2 S2 Zn -","- C200 H184 F48 N24 P8 S8 Zn4 -","4","1","","Zhang, Qiong; Tian, Xiaohe; Hu, Zhangjun; Brommesson, Caroline; Wu, Jieying; Zhou, Hongping; Li, Shengli; Yang, Jiaxiang; Sun, Zhaoqi; Tian, Yupeng; Uvdal, Kajsa","A series of Zn(ii) terpyridine complexes with enhanced two-photon-excited fluorescence for in vitro and in vivo bioimaging","Journal of Materials Chemistry B","2015","3","36","7213","","10.1039/C5TB01185J","","","0.71069","MoKα","","0.2039","0.0705","","","0.1601","0.2274","","","","","","0.961","","","","has coordinates","233967","2020-10-21","18:00:00",""
"7236153","14.035","0.004","14.277","0.004","15.099","0.005","63.305","0.003","79.986","0.004","84.168","0.004","2660.9","1.4","296","2","296","2","","","","","","","","6","P -1","-P 1","2","","","","- C25 H23 I2 N3 S Zn -","- C25 H23 I2 N3 S Zn -","- C100 H92 I8 N12 S4 Zn4 -","4","2","","Zhang, Qiong; Tian, Xiaohe; Hu, Zhangjun; Brommesson, Caroline; Wu, Jieying; Zhou, Hongping; Li, Shengli; Yang, Jiaxiang; Sun, Zhaoqi; Tian, Yupeng; Uvdal, Kajsa","A series of Zn(ii) terpyridine complexes with enhanced two-photon-excited fluorescence for in vitro and in vivo bioimaging","Journal of Materials Chemistry B","2015","3","36","7213","","10.1039/C5TB01185J","","","0.71073","MoKα","","0.1709","0.0654","","","0.1399","0.1751","","","","","","0.98","","","","has coordinates","233967","2020-10-21","18:00:00",""
"7236154","38.02","0.017","12.719","0.006","11.416","0.005","90","","96.376","0.007","90","","5486","4","298","2","298","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C33 H29 N3 S -","- C33 H29 N3 S -","- C264 H232 N24 S8 -","8","2","","Zhang, Qiong; Tian, Xiaohe; Hu, Zhangjun; Brommesson, Caroline; Wu, Jieying; Zhou, Hongping; Li, Shengli; Yang, Jiaxiang; Sun, Zhaoqi; Tian, Yupeng; Uvdal, Kajsa","A series of Zn(ii) terpyridine complexes with enhanced two-photon-excited fluorescence for in vitro and in vivo bioimaging","Journal of Materials Chemistry B","2015","3","36","7213","","10.1039/C5TB01185J","","","0.71073","MoKα","","0.2785","0.0791","","","0.0624","0.085","","","","","","0.966","","","","has coordinates,has disorder","233967","2020-10-21","18:00:00",""
"7236155","8.2244","0.0016","10.228","0.002","14.193","0.003","70.91","0.03","81.49","0.03","72.81","0.03","1076.1","0.4","298","2","298","2","","","","","","","","4","P -1","-P 1","2","","","","- C25 H23 N3 S -","- C25 H23 N3 S -","- C50 H46 N6 S2 -","2","1","","Zhang, Qiong; Tian, Xiaohe; Hu, Zhangjun; Brommesson, Caroline; Wu, Jieying; Zhou, Hongping; Li, Shengli; Yang, Jiaxiang; Sun, Zhaoqi; Tian, Yupeng; Uvdal, Kajsa","A series of Zn(ii) terpyridine complexes with enhanced two-photon-excited fluorescence for in vitro and in vivo bioimaging","Journal of Materials Chemistry B","2015","3","36","7213","","10.1039/C5TB01185J","","","0.71073","MoKα","","0.0634","0.045","","","0.1471","0.1687","","","","","","1.003","","","","has coordinates","233967","2020-10-21","18:00:00",""
"7236156","39.898","0.004","10.028","0.0008","22.1207","0.0014","90","","107.029","0.007","90","","8462.4","1.3","298","","298","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","Ru-Uracil","Ru-Uracil","","- C37 H33 F12 N9 O4 P2 Ru -","- C37 H33 F12 N9 O4 P2 Ru -","- C296 H264 F96 N72 O32 P16 Ru8 -","8","1","","Ramu, Vadde; Ali, Firoj; Taye, Nandaraj; Garai, Bikash; Alam, Aftab; Chattopadhyay, Samit; Das, Amitava","New imaging reagents for lipid dense regions in live cells and the nucleus in fixed MCF-7 cells","Journal of Materials Chemistry B","2015","3","36","7177","","10.1039/C5TB01309G","","","0.71073","MoKα","","0.1609","0.0812","","","0.1504","0.1662","","","","","","1.606","","","","has coordinates","233969","2020-10-21","18:00:00",""