# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T20:55:02+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 'X-ray Structure Analysis Online') AND volume = 35 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
"1551063","11.007","0.002","11.5591","0.0012","12.534","0.002","63.254","0.012","86.458","0.019","79.581","0.017","1400.3","0.4","123","","123","","","","","","","","","6","P -1","-P 1","2","(C29H29N5)2Fe2(OH)2(ClO4)2","","","- C58 H60 Cl2 Fe2 N10 O10 -","- C58 H60 Cl2 Fe2 N10 O10 -","- C58 H60 Cl2 Fe2 N10 O10 -","1","0.5","","Yaguchi, Reiko; Furutachi, Hideki; Shirotsuki, Sanae; Zhang, Xi; Ishikawa, Takanao; Akine, Shigehisa; Tosha, Takehiko; Fujinami, Shuhei; Suzuki, Masatatsu; Kitagawa, Teizo","Synthesis and Crystal Structure of the Bis(μ-hydroxo)diiron(II) Complex with Tridentate Ligands Having a Sterically Bulky Imidazolyl Group","X-ray Structure Analysis Online","2019","35","0","27","","10.2116/xraystruct.35.27","","","0.71073","MoKα","","0.0349","0.0328","","","0.0847","0.0862","","","","","","1.046","","","","has coordinates","215199","2020-10-21","18:00:00",""
"1551064","11.598","0.008","11.598","0.008","25.367","0.018","90","","90","","120","","2955","4","293","2","293","2","","","","","","","","7","R -3 :H","-R 3","148","","","","- C12 H36 F18 Fe O6 P3 S6 -","- C12 H36 F18.008 Fe O6 P3 S6 -","- C36 H108 F54.024 Fe3 O18 P9 S18 -","3","0.166667","","Shomura, Kaoru; Mitsuhashi, Ryoji; Mikuriya, Masahiro; Kataoka, Yusuke; Handa, Makoto; Sakiyama, Hiroshi","Crystal Structure of a Mononuclear Iron(III) Complex, Hexakis(dimethylsulfoxide-κ<i>O</i>)iron(III) Tris(hexafluoridophosphate)","X-ray Structure Analysis Online","2019","35","0","31","","10.2116/xraystruct.35.31","","","0.71073","MoKα","","0.0853","0.0509","","","0.1343","0.1565","","","","","","1.046","","","","has coordinates,has disorder","215200","2020-10-21","18:00:00",""
"1551162","9.6282","0.0009","11.0221","0.0009","13.0273","0.0012","91.05","0.004","109.419","0.004","94.574","0.002","1298.2","0.2","293","2","293","2","","","","","","","","6","P -1","-P 1","2","","","","- C26 H30 B N O5 S -","- C26 H30 B N O5 S -","- C52 H60 B2 N2 O10 S2 -","2","1","","Tombul, Mustafa","Crystal Structure of Tertiarybutyl Ammonium Bis[(naphthalene-2,3-diolato)borate] Dimethyl Sulfoxide Solvate","X-ray Structure Analysis Online","2019","35","0","3","","10.2116/xraystruct.35.3","","","0.71073","MoKα","","0.104","0.074","","","0.168","0.1924","","","","","","1.107","","","","has coordinates,has disorder","215567","2020-10-21","18:00:00",""
"1551527","18.098","0.003","4.3275","0.0008","14.572","0.003","90","","104.283","0.003","90","","1106","0.4","90","2","90","2","","","","","","","","5","P 1 2/c 1","-P 2yc","13","","","","- C19 H26 Cl2 N2 O8 -","- C19 H20 Cl2 N2 O8 -","- C38 H40 Cl4 N4 O16 -","2","0.5","","MIKURIYA, Masahiro; KOYAMA, Yoshiki; MITSUHASHI, Ryoji","Synthesis and Crystal Structure of 1,3-Bis(5-chloro-3-methoxysalicylideneamino)-2-propanol Trihydrate","X-ray Structure Analysis Online","2019","35","0","33","","10.2116/xraystruct.35.33","","","0.71073","MoKα","","0.0903","0.0734","","","0.2011","0.214","","","","","","1.093","","","","has coordinates,has disorder","216137","2020-10-21","18:00:00",""
"1551528","10.3845","0.0015","11.1976","0.0015","20.389","0.004","82.119","0.01","85.34","0.01","68.871","0.007","2189.3","0.6","123","","123","","","","","","","","","6","P -1","-P 1","2","C17H20N3O2)2Fe2(OH)2(NO3)1.9553Br0.0447(H2O)8","","","- C34 H58 Br0.04 Fe2 N7.96 O19.87 -","- C34 H58 Br0.0447 Fe2 N7.9553 O19.8659 -","- C68 H116 Br0.0894 Fe4 N15.9106 O39.7318 -","2","1","","ZHANG, Xi; FURUTACHI, Hideki; OHYAMA, Yuya; FUJINAMI, Shuhei; AKINE, Shigehisa; SUZUKI, Masatatsu","Crystal Structure of Bis(μ-hydroxo)diiron(III) Complex with Tripodal Ligands Having a Terminal Carboxylate Group","X-ray Structure Analysis Online","2019","35","0","17","","10.2116/xraystruct.35.17","","","0.71073","MoKα","","0.0481","0.0342","","","0.092","0.0972","","","","","","1.091","","","","has coordinates,has disorder","216138","2020-10-21","18:00:00",""
"1551529","13.0221","0.0014","11.6615","0.0013","8.4898","0.0009","90","","97.327","0.004","90","","1278.7","0.2","273","2","273","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","bis(2-methoxy-6-((Z)-(p-tolyimino)- methyl)phenoxy)palladium","bis(2-methoxy-6-((Z)-(p-tolyimino)- methyl)phenoxy)palladium","","- C30 H28 N2 O4 Pd -","- C30 H26 N2 O4 Pd -","- C60 H52 N4 O8 Pd2 -","2","0.5","","KASSIM, Karimah; KAHAR, Muhammad Ashraf Mohd; YAMIN, Bohari M.; MANAN, Mohd Abdul Fatah Abdul; YUSOF, M. Sukeri M.","Crystal Structure of Bis(2-methoxy-6-((<i>Z</i>)-(<i>p</i>-tolylimino)methyl)phenoxy)palladium","X-ray Structure Analysis Online","2019","35","0","25","","10.2116/xraystruct.35.25","","","0.71073","MoKα","","0.0472","0.0349","","","0.0742","0.0824","","","","","","1.185","","","","has coordinates","216139","2020-10-21","18:00:00",""
"1551530","9.90587","0.00016","14.2978","0.0002","18.6626","0.0003","90","","101.667","0.0017","90","","2588.61","0.07","173","","173","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C22 H16 Co F6 N4 O6 S2 -","- C22 H16 Co F6 N4 O6 S2 -","- C88 H64 Co4 F24 N16 O24 S8 -","4","0.5","","TOYAMA, Mari; YAMAMOTO, Yu","Crystal Structure of <i>cis</i>-Bis(2,2′-bipyridyl)bis(trifluoromethanesulfonato)cobalt(II)","X-ray Structure Analysis Online","2019","35","0","21","","10.2116/xraystruct.35.21","","","1.54187","CuKα","","0.0397","0.0381","","","0.1006","0.1016","","","","","","1.084","","","","has coordinates","216140","2020-10-21","18:00:00",""
"1551531","12.0318","0.0015","7.6706","0.001","18.617","0.002","90","","105.089","0.002","90","","1658.9","0.3","90","2","90","2","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C18 H18 N4 O2 Zn -","- C18 H18 N4 O2 Zn -","- C72 H72 N16 O8 Zn4 -","4","1","","MITSUHASHI, Ryoji; MIKURIYA, Masahiro","Synthesis and Crystal Structure of Bis[2-(2-imidazolinyl)phenolato]zinc(II)","X-ray Structure Analysis Online","2019","35","0","15","","10.2116/xraystruct.35.15","","","0.71073","MoKα","","0.0712","0.0454","","","0.098","0.1096","","","","","","1.013","","","","has coordinates","216141","2020-10-21","18:00:00",""
"1551532","34.9877","0.0014","23.3809","0.0014","18.8662","0.0005","90","","90","","90","","15433.4","1.2","93","","93","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C60 H94 Cl2 N12 O11 -","- C60 H94 Cl2 N12 O11 -","- C480 H752 Cl16 N96 O88 -","8","2","","ASANO, Akiko; DOI, Mitsunobu","Crystal Structure of Gramicidin S Hydrochloride at 1.1 Å Resolution","X-ray Structure Analysis Online","2019","35","0","1","","10.2116/xraystruct.35.1","","","1.54184","CuKα","","0.1793","0.165","","","0.4007","0.4081","","","","","","2.756","","","","has coordinates","216142","2020-10-21","18:00:00",""
"1551533","13.7667","0.0014","11.4666","0.0011","12.2213","0.0012","90","","116.242","0.002","90","","1730.4","0.3","90","2","90","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C20 H22 N4 O2 Zn -","- C20 H22 N4 O2 Zn -","- C80 H88 N16 O8 Zn4 -","4","0.5","","MITSUHASHI, Ryoji; MIKURIYA, Masahiro","Synthesis and Crystal Structure of Bis[2-(1,4,5,6-tetrahydropyrimidin-2-yl)phenolato]zinc(II)","X-ray Structure Analysis Online","2019","35","0","37","","10.2116/xraystruct.35.37","","","0.71073","MoKα","","0.0488","0.0401","","","0.1018","0.1064","","","","","","1.06","","","","has coordinates","216143","2020-10-21","18:00:00",""
"1551534","23.3026","0.0014","17.4118","0.0012","12.3816","0.0007","90","","109.032","0.008","90","","4749.1","0.6","93","2","93","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C24 H26 Cl2 N4 Pt -","- C24 H26 Cl2 N4 Pt -","- C192 H208 Cl16 N32 Pt8 -","8","1","","KIWADA, Tatsuto; HIRASAKI, Aika; ODANI, Akira","Crystal Structure of (2,2′-Bipyridine)(<i>N</i>-(1-naphthyl)methyl-1,3-propanediamine)platinum(II) Chloride","X-ray Structure Analysis Online","2019","35","0","35","","10.2116/xraystruct.35.35","","","0.71073","MoKα","","0.0335","0.0242","","","0.0466","0.049","","","","","","1.034","","","","has coordinates,has disorder","216144","2020-10-21","18:00:00",""
"1551535","21.678","0.003","16.3791","0.0016","22.447","0.003","90","","111.522","0.002","90","","7414.5","1.6","93","","93","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","(C32H40N6)Fe2(OH)2(BPh4)2(Me2CO)1.2(Et2O)0.5","","","- C85.6 H94.2 B2 Fe2 N6 O3.7 -","- C85.6 H94.2 B2 Fe2 N6 O3.7 -","- C342.4 H376.8 B8 Fe8 N24 O14.8 -","4","1","","SEKINO, Mio; FURUTACHI, Hideki; TASAKI, Kyosuke; ISHIKAWA, Takanao; FUJINAMI, Shuhei; AKINE, Shigehisa; SAKATA, Yoko; SUZUKI, Masatatsu; NOMURA, Takashi; OGURA, Takashi; KITAGAWA, Teizo","Crystal Structure of Bis(μ-hydroxo)diiron(II) Complex with a Dinucleating Ligand Having a Butyl Linker","X-ray Structure Analysis Online","2019","35","0","5","","10.2116/xraystruct.35.5","","","0.71073","MoKα","","0.0546","0.0474","","","0.1191","0.1274","","","","","","1.067","","","","has coordinates,has disorder","216145","2020-10-21","18:00:00",""
"1551536","15.569","0.001","23.826","0.0008","24.821","0.002","90","","95.346","0.0003","90","","9167.2","1","108","","108","","","","","","","","","7","C 1 c 1","C -2yc","9","[LFe2(PhCO2)(MeCN)](BF4)2_2MeCN_3EtOH","","","- C96 H101 B2 F8 Fe2 N13 O6 -","- C96 H101 B2 F8 Fe2 N13 O6 -","- C384 H404 B8 F32 Fe8 N52 O24 -","4","1","","YASUDA, Yuichi; FURUTACHI, Hideki; HAYASHI, Yosuke; ISHIZAKI, Kana; FUJINAMI, Shuhei; AKINE, Shigehisa; SUZUKI, Masatatsu; NAGATOMO, Shigenori; KITAGAWA, Teizo","Crystal Structure of μ-Phenoxo-μ-benzoate-bridged Dinuclear Fe(II) Complex with a Dinucleating Ligand Having a Sterically Bulky Imidazolyl Group","X-ray Structure Analysis Online","2019","35","0","11","","10.2116/xraystruct.35.11","","","0.71073","MoKα","","0.0367","0.0336","","","0.0825","0.085","","","","","","1.029","","","","has coordinates,has disorder","216146","2020-10-21","18:00:00",""
"1551537","12.595","0.004","6.2362","0.0018","11.529","0.003","90","","90","","90","","905.5","0.5","90","2","90","2","","","","","","","","4","P n a 21","P 2c -2n","33","","","","- C10 H12 N2 O -","- C10 H12 N2 O -","- C40 H48 N8 O4 -","4","1","","MITSUHASHI, Ryoji; MIKURIYA, Masahiro","Crystal Structure of 2-(4-Methylimidazolin-2-yl)phenol: an Another Polymorph","X-ray Structure Analysis Online","2019","35","0","9","","10.2116/xraystruct.35.9","","","0.71073","MoKα","","0.0692","0.046","","","0.093","0.0997","","","","","","1.026","","","","has coordinates,has disorder","216147","2020-10-21","18:00:00",""
"1552773","14.1365","0.0013","13.2077","0.0012","8.8865","0.0008","90","","126.365","0.003","90","","1336.1","0.2","150","2","150","2","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","","- C10 H8 Ca Cu O11 -","- C10 H8 Ca Cu O11 -","- C40 H32 Ca4 Cu4 O44 -","4","0.5","","MENG, Gaoxiang; LI, Qiang; YANG, Yongming","Crystal Structure of Catena-((μ<sub>8</sub>-benzene-1,2,4,5-tetracarboxylato)-triaqua-calcium(II)-copper(II))","X-ray Structure Analysis Online","2019","35","0","49","","10.2116/xraystruct.35.49","","","0.71073","MoKα","","0.084","0.0779","","","0.1637","0.1666","","","","","","1.086","","","","has coordinates","225370","2020-10-21","18:00:00",""
"1552774","25.0091","0.0004","5.39364","0.0001","9.37759","0.00019","90","","90","","90","","1264.94","0.04","173","","173","","","","","","","","","5","P c c n","-P 2ab 2ac","56","","","","- C8 H20 Cl N S2 -","- C8 H20 Cl N S2 -","- C32 H80 Cl4 N4 S8 -","4","0.5","","TOYAMA, Mari; CHAYAMA, Kenji","Crystal Structure of 6-Aza-3,9-dithiaundecane Hydrochloride","X-ray Structure Analysis Online","2019","35","0","55","","10.2116/xraystruct.35.55","","","1.54187","CuKα","","0.0341","0.0313","","","0.0849","0.088","","","","","","1.058","","","","has coordinates","225372","2020-10-21","18:00:00",""
"1552775","24.879","0.003","6.868","0.002","26.068","0.004","90","","110.49","0.02","90","","4172.4","1.6","296.15","","296.15","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C18 H12 N4 O2 -","- C18 H12 N4 O2 -","- C216 H144 N48 O24 -","12","3","","GUILLON, Jean; PEREIRA-ROSENFELD, Maria De Fatima; PINAUD, Noël; BESSON, Thierry; THIÉRY, Valérie; PICOT, Laurent; MARCHIVIE, Mathieu","Crystal Structure of 6,7-Dihydro-5a,7a,13,14-tetraaza-pentaphene-5,8-dione","X-ray Structure Analysis Online","2019","35","0","57","","10.2116/xraystruct.35.57","","x-ray","1.5418","CuKα","","0.142","0.1353","","","0.1898","0.1935","","","","","","1.056","","","","has coordinates","225373","2020-10-21","18:00:00",""
"1552776","8.064","0.006","13.48","0.003","13.573","0.005","113.528","0.015","104.24","0.03","100.46","0.03","1244.5","1.1","150","2","150","2","","","","","","","synthesis as described","5","P -1","-P 1","2","","","","- C54 H36 Ag6 N6 S6 -","- C54 H36 Ag6 N6 S6 -","- C54 H36 Ag6 N6 S6 -","1","0.5","","OZAWA, Yoshiki; MASUNAGA, Azusa; KUBO, Masahiro; YASUDA, Nobuhiro; TORIUMI, Koshiro","Crystal Structure of Hexakis(quinoline-2-thiolatosilver(I))","X-ray Structure Analysis Online","2019","35","0","51","","10.2116/xraystruct.35.51","","x-ray","0.83073","synchrotron","","0.0437","0.0324","","","0.075","0.0889","","","","","","1.116","","","","has coordinates","225374","2020-10-21","18:00:00",""
"1552777","11.2466","0.0007","17.3553","0.001","13.7027","0.0009","90","","100.501","0.002","90","","2629.8","0.3","298","2","298","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C28 H28 Cl2 N4 Pt -","- C28 H28 Cl2 N4 Pt -","- C112 H112 Cl8 N16 Pt4 -","4","1","","KIWADA, Tatsuto; TAKAYAMA, Hiroshi; KATAKASU, Hiromu; ODANI, Akira","Crystal Structure of [<i>N</i>-(9-Anthracenylmethyl)-1,3-propanediamine](2,2′-bipyridine)platinum(II) Chloride","X-ray Structure Analysis Online","2019","35","0","39","","10.2116/xraystruct.35.39","","","0.71075","MoKα","","0.0328","0.0271","","","0.06","0.0619","","","","","","1.085","","","","has coordinates","225375","2020-10-21","18:00:00",""
"1552778","24.96","0.0009","11.1533","0.0003","20.0575","0.0006","90","","109.439","0.004","90","","5265.4","0.3","100.15","","100.15","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C57 H58 B2 Co2 F10 N8 O2 -","- C57 H58 B2 Co2 F10 N8 O2 -","- C228 H232 B8 Co8 F40 N32 O8 -","4","0.5","","MIBU, Takuto; SUENAGA, Yusaku; OKUBO, Takashi; MAEKAWA, Masahiko; KURODA-SOWA, Takayoshi","Crystal Structure of a Dinuclear Co Complex with Doubly Bridged Fluorides: Di-μ-fluoride Bis{(2-pyridylmethyl)bis(2-quinolylmethyl)amine} Dicobalt(II) Bis(tetrafluoroborate), [Co<sub>2</sub>(μ-F)<sub>2</sub>(pbqa)<sub>2</sub>](BF<sub>4</sub>)<sub>2</sub>","X-ray Structure Analysis Online","2019","35","0","61","","10.2116/xraystruct.35.61","","x-ray","0.71073","MoKα","","0.0451","0.0403","","","0.0998","0.1018","","","","","","1.131","","","","has coordinates,has disorder","225376","2020-10-21","18:00:00",""
"1552779","8.279","0.003","10.673","0.005","10.696","0.004","64.7","0.03","95.76","0.03","91.17","0.04","849.9","0.6","296","","296","","","","","","","","","7","P -1","-P 1","2","","","","- C10 H29 Cl2 Co N5 O S -","- C10 H29 Cl2 Co N5 O S -","- C20 H58 Cl4 Co2 N10 O2 S2 -","2","1","","KUROGI, Chika; YONEMURA, Toshiaki","Crystal Structure of a Co(III) Complex with 2-Aminoethanethiol and Triethylenetetramine","X-ray Structure Analysis Online","2019","35","0","43","","10.2116/xraystruct.35.43","","","0.71069","MoKα","","0.0402","0.0385","","","0.1131","0.1145","","","","","","1.096","","","","has coordinates","225377","2020-10-21","18:00:00",""
"1552780","15.29","0.003","6.5298","0.0014","27.551","0.006","90","","105.054","0.013","90","","2656.3","1","173.1","","173.1","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","","","- C17 H15 N O2 -","- C17 H15 N O2 -","- C136 H120 N8 O16 -","8","2","","KUBO, Kanji; MATSUMOTO, Taisuke; TAKECHI, Haruko","Crystal Structure of 7-(Dimethylamino)-3-phenylcoumarin","X-ray Structure Analysis Online","2019","35","0","47","","10.2116/xraystruct.35.47","","","1.54187","CuKα","","","0.0591","","","","0.1864","","","","","","1.101","","","","has coordinates","225378","2020-10-21","18:00:00",""
"1559002","10.0912","0.0018","7.5548","0.0011","27.919","0.005","90","","94.047","0.004","90","","2123.2","0.6","93","","93","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C26 H15 N3 O8 -","- C26 H15 N3 O8 -","- C104 H60 N12 O32 -","4","1","","HONDA, Risa; TANAKA, Atsuhiko; HIRABAYASHI, Kazunori; AKIYAMA, Kazuhiko; SHIMIZU, Toshio; SUGIURA, Ken-ichi","Crystal Structure of Dinaphtho[2,1,1′,2′]furan Picrate","X-ray Structure Analysis Online","2019","35","0","69","","10.2116/xraystruct.35.69","","","0.71075","MoKα","","0.0954","0.0502","","","0.1028","0.119","","","","","","1.047","","","","has coordinates,has disorder","256207","2020-10-21","18:00:00",""