# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-11-24T08:36:03+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 'Crystals') AND volume = 10 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
"1557475","8.1042","0.0011","14.3559","0.0018","17.696","0.003","90","","103.077","0.003","90","","2005.4","0.5","150","2","150","2","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","","","- C16 H22 N2 O9 Rh2 -","- C16 H22 N2 O9 Rh2 -","- C64 H88 N8 O36 Rh8 -","4","1","","Arakawa, Kazuki; Yano, Natsumi; Imasaki, Nanako; Kohara, Yoshihiro; Yatsushiro, Daiki; Atarashi, Daiki; Handa, Makoto; Kataoka, Yusuke","Coordination-Induced Self-Assembly of a Heteroleptic Paddlewheel-Type Dirhodium Complex","Crystals","2020","10","2","85","","10.3390/cryst10020085","","","0.71075","MoKα","","0.0724","0.065","","","0.148","0.1583","","","","","","1.149","","","","has coordinates","249065","2020-10-21","18:00:00",""
"1558499","22.7973","0.0004","9.9833","0.0002","17.0522","0.0003","90","","99.954","0.002","90","","3822.53","0.12","296","1","296","1","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","","Stanfieldite","- Ca7.97 Fe0.56 Mg9.47 O48 P12 -","- Ca7.96 Fe0.566 Mg9.458 O48 P12 -","- Ca31.84 Fe2.264 Mg37.832 O192 P48 -","4","0.5","","Britvin, Sergey N.; Krzhizhanovskaya, Maria G.; Bocharov, Vladimir N.; Obolonskaya, Edita V.","Crystal Chemistry of Stanfieldite, Ca7M2Mg9(PO4)12 (M = Ca, Mg, Fe2+), a Structural Base of Ca3Mg3(PO4)4 Phosphors","Crystals","2020","10","6","464","","10.3390/cryst10060464","","x-ray","0.71073","MoKα","","0.0511","0.0339","","","0.0781","0.082","","","","","","0.921","","","","has coordinates","254013","2020-10-21","18:00:00",""
"1558500","7.8673","0.0005","11.0031","0.0007","11.7131","0.0006","82.325","0.002","89.994","0.002","81.179","0.002","992.76","0.1","100","2","100","","","","","","","","","6","P -1","-P 1","2","4,7-dichloroquinoline copper bromide comp","","","- C36 H20 Br3.77 Cl8 Cu2 N4 -","- C36 H20 Br3.7744 Cl8 Cu2 N4 -","- C36 H20 Br3.7744 Cl8 Cu2 N4 -","1","0.5","","Finocchio, Giada; Rizzato, Silvia; Macetti, Giovanni; Tusha, Gers; Lo Presti, Leonardo","Unravelling the Chemistry of the [Cu(4,7-Dichloroquinoline)2Br2]2 Dimeric Complex through Structural Analysis: A Borderline Ligand Field Case","Crystals","2020","10","6","477","","10.3390/cryst10060477","","","0.71073","MoKα","","0.0339","0.025","","","0.0636","0.0671","","","","","","1.062","","","","has coordinates","254015","2020-10-21","18:00:00",""
"1558501","19.6546","0.0008","17.9133","0.0006","24.0581","0.0011","90","","112.816","0.005","90","","7807.6","0.6","123","2","123","2","","","","","","","","7","C 1 c 1","C -2yc","9","","","","- C18 H13.5 B Cu F4 N6 O0.75 -","- C18 H13.5 B Cu F3.999 N6 O0.75 -","- C288 H216 B16 Cu16 F63.984 N96 O12 -","16","4","","Beveridge, Stuart; McAnally, Craig A.; Nichol, Gary S.; Kennedy, Alan R.; Cussen, Edmund J.; Fletcher, Ashleigh J.","Unexpected Selective Gas Adsorption on a ‘Non-Porous’ Metal Organic Framework","Crystals","2020","10","6","548","","10.3390/cryst10060548","","","0.71073","MoKα","","0.0666","0.051","","","0.1226","0.1341","","","","","","1.037","","","","has coordinates,has disorder","254016","2020-10-21","18:00:00",""
"1559469","15.072","0.002","7.9873","0.0009","6.841","0.0009","90","","90","","90","","823.55","0.18","18","1","18","1","","","","","","","","4","P b c n","-P 2n 2ab","60","bis(dimethylamino)squaraine","","","- C8 H12 N2 O2 -","- C8 H12 N2 O2 -","- C32 H48 N8 O8 -","4","0.5","","Destro, Riccardo; Roversi, Pietro; Soave, Raffaella; Hovestad, Arjan; Lo Presti, Leonardo","Experimental Charge Density Analysis and Electrostatic Properties of Crystalline 1,3-Bis(Dimethylamino)Squaraine and Its Dihydrate from Low Temperature (T = 18 and 20 K) XRD Data","Crystals","2020","10","10","894","","10.3390/cryst10100894","","","0.71073","MoKα","","0.0417","0.0314","","","0.0896","0.0989","","","","","","1.113","","","","has coordinates","259000","2020-11-06","15:09:55",""
"1559470","7.959","0.001","7.154","0.001","17.799","0.002","90","","91.68","0.01","90","","1013","0.2","20","1","20","1","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","bis(dimethylamino)squaraine dihydrate","","","- C8 H16 N2 O4 -","- C8 H16 N2 O4 -","- C32 H64 N8 O16 -","4","1","","Destro, Riccardo; Roversi, Pietro; Soave, Raffaella; Hovestad, Arjan; Lo Presti, Leonardo","Experimental Charge Density Analysis and Electrostatic Properties of Crystalline 1,3-Bis(Dimethylamino)Squaraine and Its Dihydrate from Low Temperature (T = 18 and 20 K) XRD Data","Crystals","2020","10","10","894","","10.3390/cryst10100894","","","0.71073","MoKα","","0.0383","0.0305","","","0.0834","0.0867","","","","","","1.052","","","","has coordinates","259000","2020-11-06","15:09:56",""
"1559471","15.4996","0.0006","23.6435","0.0007","9.0231","0.0002","90","","90","","90","","3306.65","0.18","100","2","100","2","","","","","","","","2","P n n m","-P 2 2n","58","","","","- Bi6 Br7 -","- Bi6 Br7 -","- Bi48 Br56 -","8","1","","Stroganova, Ekaterina A.; Troyanov, Sergey I.; Morozov, Igor V.; Kuznetsov, Alexey N.","Bismuth Polycations Revisited: Alternative Synthesis and Electronic Structure of Bi6Br7, and Bonding in Main-Group Polyatomic Ions from a Direct Space Perspective","Crystals","2020","10","10","940","","10.3390/cryst10100940","","","0.71073","MoKα","","0.0676","0.0413","","","0.0764","0.0837","","","","","","0.883","","","","has coordinates","259001","2020-11-06","15:10:26",""
"1559472","12.0654","0.0005","11.0666","0.0005","23.955","0.0011","90","","101.376","0.0016","90","","3135.7","0.2","223","2","223","2","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C19 H16 O6 -","- C19 H16 O6 -","- C152 H128 O48 -","8","2","","Shin, Soon Young; Lee, Young Han; Lim, Yoongho; Lee, Ha Jin; Lee, Ji Hye; Yoo, Miri; Ahn, Seunghyun; Koh, Dongsoo","Single Crystal X-Ray Structure for the Disordered Two Independent Molecules of Novel Isoflavone: Synthesis, Hirshfeld Surface Analysis, Inhibition and Docking Studies on IKKβ of 3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-6,7-dimethoxy-4H-chromen-4-one","Crystals","2020","10","10","911","","10.3390/cryst10100911","","","0.71073","MoKα","","0.0666","0.043","","","0.1004","0.1179","","","","","","1.063","","","","has coordinates,has disorder","259002","2020-11-06","15:10:52",""