# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-30T17:14:06+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 'Analytical chemistry') AND volume = 89 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
"1545273","15.8245","0.0003","8.2945","0.0002","19.2897","0.0004","90","","106.414","0.002","90","","2428.71","0.09","173","0.1","173","0.1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H30 N6 O2 -","- C26 H30 N6 O2 -","- C104 H120 N24 O8 -","4","1","","Peng, Lu; Xu, Shidang; Zheng, Xiaokun; Cheng, Xiamin; Zhang, Ruoyu; Liu, Jie; Liu, Bin; Tong, Aijun","Rational Design of a Red-Emissive Fluorophore with AIE and ESIPT Characteristics and Its Application in Light-Up Sensing of Esterase.","Analytical chemistry","2017","89","5","3162","3168","10.1021/acs.analchem.6b04974","","","1.54178","CuKα","","0.0798","0.0581","","","0.1085","0.1176","","","","","","1.078","","","","has coordinates,has disorder","194776","2020-10-21","18:00:00",""
"1545274","8.2282","0.0004","6.994","0.0003","22.3201","0.0009","90","","91.01","0.004","90","","1284.28","0.1","298.6","0.4","298.6","0.4","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H13 N5 O -","- C13 H13 N5 O -","- C52 H52 N20 O4 -","4","1","","Peng, Lu; Xu, Shidang; Zheng, Xiaokun; Cheng, Xiamin; Zhang, Ruoyu; Liu, Jie; Liu, Bin; Tong, Aijun","Rational Design of a Red-Emissive Fluorophore with AIE and ESIPT Characteristics and Its Application in Light-Up Sensing of Esterase.","Analytical chemistry","2017","89","5","3162","3168","10.1021/acs.analchem.6b04974","","","1.54178","CuKα","","0.0623","0.0426","","","0.0672","0.0725","","","","","","1.022","","","","has coordinates","194776","2020-10-21","18:00:00",""
"1545668","9.956","0.002","7.274","0.0015","21.198","0.004","90","","91.92","0.03","90","","1534.3","0.5","153","2","153","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C15 H17 N5 O -","- C15 H17 N5 O -","- C60 H68 N20 O4 -","4","1","","Peng, Lu; Xu, Shidang; Zheng, Xiaokun; Cheng, Xiamin; Zhang, Ruoyu; Liu, Jie; Liu, Bin; Tong, Aijun","Rational Design of a Red-Emissive Fluorophore with AIE and ESIPT Characteristics and Its Application in Light-Up Sensing of Esterase.","Analytical chemistry","2017","89","5","3162","3168","10.1021/acs.analchem.6b04974","","","0.71073","MoKα","","0.1338","0.0887","","","0.1217","0.1386","","","","","","1.071","","","","has coordinates,has disorder","194661","2020-10-21","18:00:00",""
"1545920","15.402","0.004","17.812","0.004","18.047","0.005","87.569","0.006","85.646","0.005","71.376","0.005","4677","2","173","","173","","","","","","","","","7","P -1","-P 1","2","","","","- C181 H119 Cl15 N16 O22 P6 Zr4 -","- C181 H119 Cl15 N16 O22 P6 Zr4 -","- C181 H119 Cl15 N16 O22 P6 Zr4 -","1","0.5","","Yagi, Yuma; Masaki, Shuhei; Iwata, Tetsuki; Nakane, Daisuke; Yasui, Takashi; Yuchi, Akio","Triphosphate Ion-Selective Electrode Based on Zr-Porphyrin Complex.","Analytical chemistry","2017","89","7","3937","3942","10.1021/acs.analchem.6b03754","","","0.7107","MoKα","","","0.1012","","","","0.2925","","","","","","1.609","","","","has coordinates","195934","2020-10-21","18:00:00",""
"1547198","11.0775","0.0003","16.52","0.001","37.7334","0.0013","90","","90","","90","","6905.2","0.5","99.98","0.13","99.98","0.13","","","","","","","","4","P b c 21","P 2c -2b","29","","","","- C21 H21 N2 O1.5 -","- C21 H21 N2 O1.5 -","- C336 H336 N32 O24 -","16","4","","Roy, Biswajit; Halder, Sudipta; Guha, Abhishek; Bandyopadhyay, Subhajit","Highly Selective Sub-ppm Naked-Eye Detection of Hydrazine with Conjugated-1,3-Diketo Probes: Imaging Hydrazine in Drosophila Larvae.","Analytical chemistry","2017","89","19","10625","10636","10.1021/acs.analchem.7b03503","","x-ray","0.71073","MoKα","","0.0928","0.0849","","","0.184","0.1898","","","","","","1.048","","","","has coordinates","214153","2020-10-21","18:00:00",""
"1547199","14.1242","0.0011","7.793","0.0005","14.2055","0.001","90","","100.715","0.008","90","","1536.34","0.19","99.99","0.1","99.99","0.1","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","","","- C22 H16 O2 -","- C22 H16 O2 -","- C88 H64 O8 -","4","1","","Roy, Biswajit; Halder, Sudipta; Guha, Abhishek; Bandyopadhyay, Subhajit","Highly Selective Sub-ppm Naked-Eye Detection of Hydrazine with Conjugated-1,3-Diketo Probes: Imaging Hydrazine in Drosophila Larvae.","Analytical chemistry","2017","89","19","10625","10636","10.1021/acs.analchem.7b03503","","x-ray","0.71073","MoKα","","0.058","0.0482","","","0.1178","0.1258","","","","","","1.081","","","","has coordinates","201744","2020-10-21","18:00:00",""
"1547200","17.5147","0.0011","33.238","0.002","5.0184","0.0005","90","","90","","90","","2921.5","0.4","100","0.1","100","0.1","","","","","","","","3","P n 21 a","P -2ac -2n","33","","","","- C20 H16 O2 -","- C20 H16 O2 -","- C160 H128 O16 -","8","2","","Roy, Biswajit; Halder, Sudipta; Guha, Abhishek; Bandyopadhyay, Subhajit","Highly Selective Sub-ppm Naked-Eye Detection of Hydrazine with Conjugated-1,3-Diketo Probes: Imaging Hydrazine in Drosophila Larvae.","Analytical chemistry","2017","89","19","10625","10636","10.1021/acs.analchem.7b03503","","x-ray","0.71073","MoKα","","0.0575","0.0499","","","0.1159","0.1217","","","","","","1.113","","","","has coordinates","214153","2020-10-21","18:00:00",""
"1547216","15.6924","0.0002","16.072","0.0002","11.3076","0.0001","90","","121.385","0.001","90","","2434.6","0.05","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C16 H24 Cl2 Co N8 O8 -","- C16 H24 Cl2 Co N8 O8 -","- C64 H96 Cl8 Co4 N32 O32 -","4","1","","Usov, Pavel M.; Simonov, Alexandr N.; Bond, Alan M.; Murphy, Michael J.; D'Alessandro, Deanna M","Untangling Complex Redox Chemistry in Zeolitic Imidazolate Frameworks Using Fourier Transformed Alternating Current Voltammetry.","Analytical chemistry","2017","89","19","10181","10187","10.1021/acs.analchem.7b01224","","","1.54184","CuKα","","0.0363","0.0354","","","0.0883","0.0889","","","","","","1.055","","","","has coordinates,has disorder","201743","2020-10-21","18:00:00",""
"1547217","15.6929","0.0003","16.0879","0.0004","11.3047","0.0002","90","","121.482","0.003","90","","2433.95","0.12","150","2","150","2","","","","","","","","6","C 1 c 1","C -2yc","9","","","","- C16 H24 Cl2 N8 O8 Zn -","- C16 H24 Cl2 N8 O8 Zn -","- C64 H96 Cl8 N32 O32 Zn4 -","4","1","","Usov, Pavel M.; Simonov, Alexandr N.; Bond, Alan M.; Murphy, Michael J.; D'Alessandro, Deanna M","Untangling Complex Redox Chemistry in Zeolitic Imidazolate Frameworks Using Fourier Transformed Alternating Current Voltammetry.","Analytical chemistry","2017","89","19","10181","10187","10.1021/acs.analchem.7b01224","","","1.54178","CuKα","","0.0547","0.0544","","","0.1295","0.1298","","","","","","1.085","","","","has coordinates,has disorder","201743","2020-10-21","18:00:00",""
"1552957","11.7721","0.0005","14.2054","0.0006","6.1836","0.0003","90","","90","","90","","1034.07","0.08","100","","100","","","","","","","","","5","P 21 21 2","P 2 2ab","18","Rochelle Salt","Potassium sodium tartrate tetrahydrate","","- C4 H12 K Na O10 -","- C4 H12 K Na O10 -","- C16 H48 K4 Na4 O40 -","4","1","","Macdonald, Niall P.; Bunton, Grace L.; Park, Ah Young; Breadmore, Michael C.; Kilah, Nathan L.","3D Printed Micrometer-Scale Polymer Mounts for Single Crystal Analysis.","Analytical chemistry","2017","89","8","4405","4408","10.1021/acs.analchem.7b00443","","x-ray","1.54178","CuKα","","0.0185","0.0182","","","0.0418","0.042","","","","","","1.075","","","","has coordinates","231208","2020-10-21","18:00:00",""
"1552958","11.7708","0.0004","14.2037","0.0005","6.1841","0.0002","90","","90","","90","","1033.91","0.06","100","","100","","","","","","","","","5","P 21 21 2","P 2 2ab","18","Rochelle Salt","Potassium sodium tartrate tetrahydrate","","- C4 H12 K Na O10 -","- C4 H12 K Na O10 -","- C16 H48 K4 Na4 O40 -","4","1","","Macdonald, Niall P.; Bunton, Grace L.; Park, Ah Young; Breadmore, Michael C.; Kilah, Nathan L.","3D Printed Micrometer-Scale Polymer Mounts for Single Crystal Analysis.","Analytical chemistry","2017","89","8","4405","4408","10.1021/acs.analchem.7b00443","","x-ray","1.54178","CuKα","","0.0185","0.018","","","0.0405","0.0407","","","","","","1.066","","","","has coordinates","231208","2020-10-21","18:00:00",""