# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-22T02:14:12+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 'X-ray Structure Analysis Online') AND volume = 32 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
"1551597","7.8868","0.0002","8.1577","0.0003","16.1069","0.0005","85.5626","0.0019","77.79","0.002","67.5381","0.0018","936","0.05","113","","113","","","","","","","","","5","P -1","-P 1","2","","","","- C17 H21 N O5 S2 -","- C17 H21 N O5 S2 -","- C34 H42 N2 O10 S4 -","2","1","","NAGASE, Hiromasa; KOBAYASHI, Masaru; UEDA, Haruhisa; FURUISHI, Takayuki; GUNJI, Mihoko; ENDO, Tomohiro; YONEMOCHI, Etsuo","Crystal Structure of an Epalrestat Dimethanol Solvate","X-ray Structure Analysis Online","2016","32","0","7","","10.2116/xraystruct.32.7","","","1.54187","CuKα","","0.0658","0.0558","","","0.1637","0.173","","","","","","1.178","","","","has coordinates","216207","2020-10-21","18:00:00",""
"1551598","6.345","0.002","9.631","0.004","7.805","0.003","90","","112.462","0.005","90","","440.8","0.3","90","2","90","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C10 H12 N2 O -","- C10 H12 N2 O -","- C20 H24 N4 O2 -","2","1","","MITSUHASHI, Ryoji; UEDA, Takaaki; HOSOYA, Satoshi; MIKURIYA, Masahiro","Synthesis and Crystal Structure of (<i>R</i>)-2-(4-Methylimidazolin-2-yl)phenol","X-ray Structure Analysis Online","2016","32","0","59","","10.2116/xraystruct.32.59","","","0.71073","MoKα","","0.0438","0.0346","","","0.0746","0.0787","","","","","","1.02","","","","has coordinates","216208","2020-10-21","18:00:00",""
"1551599","23.6829","0.0013","7.5558","0.0004","24.1777","0.0013","90","","90","","90","","4326.4","0.4","295","2","295","2","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C10 H9 Br N4 O -","- C10 H9 Br N4 O -","- C160 H144 Br16 N64 O16 -","16","2","","HWANG, Long-Chih; CHUANG, Chung-Lin; SU, Chun-Wei; LEE, Gene-Hsiang","Packing of Two Independent Molecules: 3-Amino-2-benzyl-6-bromo-1,2,4-triazin-5(2<i>H</i>)-one","X-ray Structure Analysis Online","2016","32","0","33","","10.2116/xraystruct.32.33","","","0.71073","MoKα","","0.1003","0.0527","","","0.1161","0.1348","","","","","","1.06","","","","has coordinates","216209","2020-10-21","18:00:00",""
"1551600","8.616","0.005","22.925","0.012","8.991","0.005","90","","94.415","0.006","90","","1770.6","1.7","173","","173","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C10 H28 Cl2 N2 O2 Ru S2 -","- C10 H28 Cl2 N2 O2 Ru S2 -","- C40 H112 Cl8 N8 O8 Ru4 S8 -","4","1","","TOYAMA, Mari; IWATSUKI, Satoshi; NAGAO, Noriharu","Crystal Structure of <i>Trans</i>(Cl),<i>cis</i>(S)-dichlorobis(dimethyl sulfoxide-<i>S</i>)(<i>N,N,N</i>′,<i>N</i>′-tetramethylethylenediamine)ruthenium(II)","X-ray Structure Analysis Online","2016","32","0","25","","10.2116/xraystruct.32.25","","","0.71075","MoKα","","0.0668","0.054","","","0.1305","0.1359","","","","","","1.015","","","","has coordinates","216211","2020-10-21","18:00:00",""
"1551601","8.7375","0.0016","9.3944","0.0017","11.712","0.002","107.747","0.003","93.435","0.003","91.447","0.003","913","0.3","240","2","240","2","","","","","","","synthesis","3","P -1","-P 1","2","ocpf","","","- C20 H18 O10 -","- C20 H18 O10 -","- C40 H36 O20 -","2","1","","YAMAGUCHI, Takako; HOSHINO, Mitsuru; MIYACHI, Kanako; KAMINO, Shinichiro; NAKAHARA, Ryousuke; DOI, Mitsunobu; ASANO, Mamiko; MATSUMURA, Hitoshi; FUJITA, Yoshikazu","Crystal Structure of <i>o</i>-Carboxyphenylfluorone as a Multifunctional Dye","X-ray Structure Analysis Online","2016","32","0","9","","10.2116/xraystruct.32.9","","","0.71073","MoKα","","0.0842","0.074","","","0.215","0.2267","","","","","","1.104","","","","has coordinates,has disorder","216212","2020-10-21","18:00:00",""
"1551602","27.234","0.007","7.4964","0.0017","6.8201","0.0018","90","","93.803","0.018","90","","1389.3","0.6","123","","123","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C30 H42 N2 O4 -","- C30 H42 N2 O4 -","- C60 H84 N4 O8 -","2","0.5","","KUBO, Kanji; YAMAMOTO, Emi; MATSUMOTO, Taisuke; MORI, Akira","Crystal Structure of <i>N,N</i>′-Bis(4-hexyloxybenzoyl)piperazine","X-ray Structure Analysis Online","2016","32","0","19","","10.2116/xraystruct.32.19","","","1.54187","CuKα","","","0.0633","","","","0.1337","","","","","","0.829","","","","has coordinates","216213","2020-10-21","18:00:00",""
"1551603","10.799","0.005","11.339","0.005","11.703","0.005","109.294","0.009","114.158","0.007","102.452","0.009","1127","0.9","90","2","90","2","","","","","","","","6","P -1","-P 1","2","","","","- C34 H62 N2 O20 S2 V4 -","- C34 H62 N2 O20 S2 V4 -","- C34 H62 N2 O20 S2 V4 -","1","0.5","","MIKURIYA, Masahiro; FUKUTANI, Masami; OMOTE, Masataka; YOSHIOKA, Daisuke; MITSUHASHI, Ryoji","Synthesis and Crystal Structure of a Tetranuclear Oxidovanadium(IV) Complex with 2,6-Bis(hydroxymethyl)-4-methylphenol","X-ray Structure Analysis Online","2016","32","0","15","","10.2116/xraystruct.32.15","","","0.71073","MoKα","","0.085","0.0548","","","0.1025","0.1126","","","","","","0.985","","","","has coordinates","216214","2020-10-21","18:00:00",""
"1551604","6.8192","0.0017","9.204","0.003","10.178","0.003","108.65","0.03","106.23","0.02","92.71","0.03","574.6","0.3","123","","123","","","","","","","","","4","P -1","-P 1","2","","","","- C26 H34 N2 O4 -","- C26 H34 N2 O4 -","- C26 H34 N2 O4 -","1","0.5","","KUBO, Kanji; YAMAMOTO, Emi; MATSUMOTO, Taisuke; MORI, Akira","Crystal Structure of <i>N,N</i>′-Bis(5-butoxytropon-2-yl)piperazine","X-ray Structure Analysis Online","2016","32","0","37","","10.2116/xraystruct.32.37","","","0.71075","MoKα","","","0.0455","","","","0.1089","","","","","","1.085","","","","has coordinates","216215","2020-10-21","18:00:00",""
"1551605","30.231","0.005","9.2503","0.0014","22.083","0.003","90","","90","","90","","6175.4","1.6","90","2","90","2","","","","","","","","6","P c a 21","P 2c -2ac","29","","","","- C66 H82 B2 N6 O6 Zn -","- C66 H82 B2 N6 O6 Zn -","- C264 H328 B8 N24 O24 Zn4 -","4","1","","ITO, Misaki; MITSUHASHI, Ryoji; MIKURIYA, Masahiro; SAKIYAMA, Hiroshi","Crystal Structure of a Trigonally Compressed Hexakis-DMF Zinc(II) Complex","X-ray Structure Analysis Online","2016","32","0","21","","10.2116/xraystruct.32.21","","","0.71073","MoKα","","0.0601","0.0365","","","0.0672","0.0744","","","","","","0.634","","","","has coordinates","216216","2020-10-21","18:00:00",""
"1551606","16.669","0.004","9.933","0.002","26.907","0.006","90","","90","","90","","4455.1","1.7","188","2","188","1","","","","","","","","5","P c a 21","P 2c -2ac","29","","","","- C24 H27 B Ge O2 -","- C24 H27 B Ge O2 -","- C192 H216 B8 Ge8 O16 -","8","2","","BOWES, Eric G.; VOGELS, Christopher M.; DECKEN, Andreas; WESTCOTT, Stephen A.","Synthesis and Molecular Structure of Ph<sub>3</sub>GeBO<sub>2</sub>C<sub>2</sub>Me<sub>4</sub>","X-ray Structure Analysis Online","2016","32","0","35","","10.2116/xraystruct.32.35","","x-ray","0.71073","MoKα","","0.0665","0.0463","","","0.1077","0.1196","","","","","","1.06","","","","has coordinates","216217","2020-10-21","18:00:00",""
"1551607","6.432","0.003","10.098","0.005","22.74","0.011","90","0.009","90","0.009","90","0.009","1477","1.2","293","2","293","2","","","","","","","","6","P 21 21 21","P 2ac 2ab","19","","","","- C10 H16 Co K N2 O10 -","- C10 H12 Co K N2 O10 -","- C40 H48 Co4 K4 N8 O40 -","4","1","","MITSUHASHI, Ryoji; MIKURIYA, Masahiro","Synthesis and Crystal Structure of Potassium Ethylenediaminetetraacetato-cobaltate(III)","X-ray Structure Analysis Online","2016","32","0","5","","10.2116/xraystruct.32.5","","","0.71073","MoKα","","0.0308","0.0283","","","0.0714","0.0722","","","","","","1.038","","","","has coordinates","216218","2020-10-21","18:00:00",""
"1551608","6.716","0.001","8.323","0.002","9.453","0.002","82.75","0.02","86.17","0.01","68.75","0.01","488.41","0.18","293","2","293","2","","","","","","","","5","P -1","-P 1","2","","","","- C10 H8 F N O4 -","- C10 H8 F N O4 -","- C20 H16 F2 N2 O8 -","2","1","","GUILLON, Jean; RONGA, Luisa; MARCHIVIE, Mathieu; MOREAU, Stéphane","Crystal Structure of (<i>E</i>)-1-(3,4-Methylenedioxy-6-fluorophenyl)-2-nitropropene","X-ray Structure Analysis Online","2016","32","0","23","","10.2116/xraystruct.32.23","","","1.5418","CuKα","","0.0514","0.0439","","","0.1255","0.134","","","","","","1.065","","","","has coordinates","216219","2020-10-21","18:00:00",""
"1551609","14.915","0.0018","10.2522","0.0012","26.964","0.004","90","","103.127","0.003","90","","4015.4","0.9","90","2","90","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C43 H47 B N2 O7 Zn2 -","- C43 H47 B N2 O7 Zn2 -","- C172 H188 B4 N8 O28 Zn8 -","4","1","","ITO, Misaki; MITSUHASHI, Ryoji; MIKURIYA, Masahiro; SAKIYAMA, Hiroshi","Crystal Structure of a Dinuclear Zinc(II) Complex with a Phenol-based Dinucleating Ligand","X-ray Structure Analysis Online","2016","32","0","13","","10.2116/xraystruct.32.13","","","0.71073","MoKα","","0.0608","0.0351","","","0.0594","0.0631","","","","","","0.801","","","","has coordinates","216220","2020-10-21","18:00:00",""
"1551610","13.277","0.002","5.2887","0.0007","21.962","0.005","90","","99.542","0.006","90","","1520.8","0.5","100","2","100","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H20 N O3 P -","- C16 H20 N O3 P -","- C64 H80 N4 O12 P4 -","4","1","","HAMZEHEE, Farahnaz; POURAYOUBI, Mehrdad; CHOQUESILLO-LAZARTE, Duane","Synthesis, Spectroscopic Study and Crystal Structure of a New Amidophosphonate, (C<sub>6</sub>H<sub>5</sub>O)<sub>2</sub>P(O)(NHCH(CH<sub>3</sub>)(C<sub>2</sub>H<sub>5</sub>))","X-ray Structure Analysis Online","2016","32","0","47","","10.2116/xraystruct.32.47","","","0.71073","MoKα","","0.1093","0.0725","","","0.1485","0.1651","","","","","","1.074","","","","has coordinates","216221","2020-10-21","18:00:00",""
"1551611","8.4258","0.0008","25.4258","0.0018","5.5515","0.0006","90","","103.301","0.004","90","","1157.41","0.19","153","2","153.15","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C12 H12 I N O2 -","- C12 H12 I N O2 -","- C48 H48 I4 N4 O8 -","4","1","","GUILLON, Jean; RONGA, Luisa; MARCHIVIE, Mathieu; LISOWSKI, Vincent","Crystal Structure of 7-Amino-4-iodo-3-propyl-1<i>H</i>-isochromen-1-one","X-ray Structure Analysis Online","2016","32","0","45","","10.2116/xraystruct.32.45","","","1.54178","CuKα","","0.074","0.0623","","","0.1621","0.1725","","","","","","1.075","","","","has coordinates","216222","2020-10-21","18:00:00",""
"1551612","19.748","0.002","5.9608","0.0007","22.948","0.003","90","","113.455","0.001","90","","2478.1","0.5","173","2","173","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C24 H36 N4 O2 Pt -","- C24 H36 N4 O2 Pt -","- C96 H144 N16 O8 Pt4 -","4","1","","MASUYA-SUZUKI, Atsuko; IKI, Nobuhiko","Crystal Structure of the <i>cis</i>-Bis(3-<i>tert</i>-butyl-<i>o</i>-diiminobenzosemiquinonato)platinum(II) Complex","X-ray Structure Analysis Online","2016","32","0","41","","10.2116/xraystruct.32.41","","","0.71073","MoKα","","0.0353","0.027","","","0.0614","0.0651","","","","","","1.04","","","","has coordinates","216223","2020-10-21","18:00:00",""
"1551613","9","0.003","11.561","0.003","10.591","0.003","90","","96.5568","0.0014","90","","1094.8","0.6","123.1","","123","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C12 H12 Br N O2 -","- C12 H12 Br N O2 -","- C48 H48 Br4 N4 O8 -","4","1","","KUBO, Kanji; MATSUMOTO, Taisuke; TAKECHI, Haruko","Crystal Structure of 3-Bromo-7-(dimethylamino)-4-methylcoumarin","X-ray Structure Analysis Online","2016","32","0","3","","10.2116/xraystruct.32.3","","","0.7107","MoKα","","","0.0426","","","","0.1217","","","","","","1.096","","","","has coordinates","216224","2020-10-21","18:00:00",""
"1551614","7.78174","0.00014","9.71395","0.00018","63.5236","0.0012","90","","92.4271","0.0007","90","","4797.53","0.15","173","2","173","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","acedoben-dimepranol (4:2)","4-acetamidobenzoic acid - N,N-dimethylamino-2-propanol (4:2)","","- C23 H31 N3 O7 -","- C23 H31 N3 O7 -","- C184 H248 N24 O56 -","8","2","","YOSHIDA, Tomomi; UMEDA, Daiki; PUTRA, Okky Dwichandra; UEKUSA, Hidehiro; YONEMOCHI, Etsuo","Drug-drug Multi-component Crystal of Acedoben‒Dimepranol 2:1","X-ray Structure Analysis Online","2016","32","0","39","","10.2116/xraystruct.32.39","","","1.54186","CuKα","","0.0565","0.0443","","","0.1241","0.1319","","","","","","1.255","","","","has coordinates","216225","2020-10-21","18:00:00",""
"1551615","10.816","0.002","12.803","0.002","15.812","0.003","109.245","0.003","95.243","0.004","92.303","0.003","2052.8","0.6","90","2","90","2","","","","","","","","5","P -1","-P 1","2","","","","- C38.5 H35.75 Co2 N9.75 O15.25 -","- C38.5 H35.25 Co2 N9.75 O15.25 -","- C77 H70.5 Co4 N19.5 O30.5 -","2","1","","MIKURIYA, Masahiro; NAKA, Yuko; YOSHIOKA, Daisuke; HANDA, Makoto","Synthesis and Crystal Structures of Dinuclear Cobalt(III) Complexes with 1,3-Bis(5-nitrosalicylideneamino)-2-propanol and 1,3-Bis(3-nitrosalicylideneamino)-2-propanol","X-ray Structure Analysis Online","2016","32","0","55","","10.2116/xraystruct.32.55","","","0.71073","MoKα","","0.0954","0.0469","","","0.1045","0.1207","","","","","","0.923","","","","has coordinates,has disorder","216226","2020-10-21","18:00:00",""
"1551616","31.56","0.019","17.013","0.01","18.888","0.012","90","","124.334","0.009","90","","8375","9","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C39 H37.5 Co2 N10 O15.75 -","- C39 H36 Co2 N10 O15.75 -","- C312 H288 Co16 N80 O126 -","8","1","","MIKURIYA, Masahiro; NAKA, Yuko; YOSHIOKA, Daisuke; HANDA, Makoto","Synthesis and Crystal Structures of Dinuclear Cobalt(III) Complexes with 1,3-Bis(5-nitrosalicylideneamino)-2-propanol and 1,3-Bis(3-nitrosalicylideneamino)-2-propanol","X-ray Structure Analysis Online","2016","32","0","55","","10.2116/xraystruct.32.55","","","0.71073","MoKα","","0.0831","0.05","","","0.1265","0.1376","","","","","","0.907","","","","has coordinates,has disorder","216227","2020-10-21","18:00:00",""
"1551617","10.638","0.002","11.483","0.002","23.538","0.004","90","","95.505","0.003","90","","2862.1","0.9","113","","113","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C31 H29 Mn N2 Ni O7 -","- C31 H29 Mn N2 Ni O7 -","- C124 H116 Mn4 N8 Ni4 O28 -","4","1","","YOSHITAKE, Megumi; YONEDA, Ko; YAMADA, Yasunori; KOIKAWA, Masayuki","Synthesis and Crystal Structure of a Tetranuclear Mn(III)-Ni(II) Heterometal Complex of <i>N</i>-(2-oxymethylphenyl)salicylideneimine","X-ray Structure Analysis Online","2016","32","0","1","","10.2116/xraystruct.32.1","","","0.71075","MoKα","","0.097","0.0682","","","0.1102","0.12","","","","","","1.13","","","","has coordinates","216228","2020-10-21","18:00:00",""
"1551618","45.69","0.008","45.69","0.008","12.589","0.002","90","0.004","90","0.004","120","0.003","22760","7","90","2","90","2","","","","","","","","6","R -3 :H","-R 3","148","","","","- C34 H64 N2 O21 S2 V4 -","- C28 H45 N O20 S2 V4 -","- C504 H810 N18 O360 S36 V72 -","18","1","","MIKURIYA, Masahiro; FUKUTANI, Masami; OMOTE, Masataka; YOSHIOKA, Daisuke; MITSUHASHI, Ryoji; TANAKA, Hidekazu; HANDA, Makoto","Synthesis and Crystal Structure of Another Tetranuclear Oxidovanadium(IV) Complex with 2,6-Bis(hydroxymethyl)-4-methylphenol Having an N<sub>2</sub>-Adsorption Property","X-ray Structure Analysis Online","2016","32","0","29","","10.2116/xraystruct.32.29","","","0.71073","MoKα","","0.0988","0.0614","","","0.1516","0.1702","","","","","","0.904","","","","has coordinates","216229","2020-10-21","18:00:00",""