# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T19:52:12+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 'Inorganic Chemistry') AND volume = 28 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
"4331397","5.593","","5.593","","20.379","","90","","90","","90","","637.489","","","","","","","","","","","","","3","I 4/m","-I 4","87","","(Xe F5) (Ag F4)","","- Ag F9 Xe -","- Ag F9 Xe -","- Ag4 F36 Xe4 -","4","0.25","","Zemva, B.; Leban, I.; Jesih, A.; Bartlett, N.; Lutar, K.","Crystal Structures of Xe F5(+)MF4(-) (M=Ag,Au) and Their Relevance to the Basicity and Oxidizability of MF4(-)","Inorganic Chemistry","1989","28","","3467","3471","10.1021/ic00317a014","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4343682","21.128","","21.128","","7.769","","90","","90","","120","","3003.4","","","","","","","","","","","","","4","R -3 :H","-R 3","148","","Zn (H2 (P O3))2 (H2 O)3","","- H2 O6 P2 Zn -","- H2 O6 P2 Zn -","- H36 O108 P36 Zn18 -","18","1","","Ortiz-Avila, C.Y.; Squattrito, P.J.; Shieh, M.; Clearfield, A.","Synthesis and chracterization of a new series of zinc phosphites","Inorganic Chemistry","1989","28","","2608","2615","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344360","8.921","","12.551","","16.444","","95.65","","104.53","","100.83","","1729.92","","","","","","","","","","","","","4","P -1","-P 1","2","","((Fe (C O)3)2 (C O)) (Fe (C O)4)4 Sn2","","- C23 Fe6 O23 Sn2 -","- C23 Fe6 O23 Sn2 -","- C46 Fe12 O46 Sn4 -","2","1","","Anema, S.G.; MacKay, K.M.; Nicholson, B.K.","Characterization of open clusters with linked Ge Fe2 or Sn Fe2 triangles: Structures of Ge2 Fe6 (C O)23, Sn2 Fe6 (C O)23, and Ge2 Fe7 (C O)26","Inorganic Chemistry","1989","28","","3158","3164","","","","","","","","","","","","","","","","","","","","","","has coordinates","168533","2020-10-21","18:00:00",""
"4344361","17.25","","17.14","","25.89","","90","","90","","90","","7654.77","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","((Fe (C O)3)3 (C O)) (Fe (C O)4)4 Ge2","","- C26 Fe7 Ge2 O26 -","- C26 Fe7 Ge2 O26 -","- C208 Fe56 Ge16 O208 -","8","1","","Anema, S.G.; Nicholson, B.K.; MacKay, K.M.","Characterization of open clusters with linked Ge Fe2 or Sn Fe2 triangles: Structures of Ge2 Fe6 (C O)23, Sn2 Fe6 (C O)23, and Ge2 Fe7 (C O)26","Inorganic Chemistry","1989","28","","3158","3164","","","","","","","","","","","","","","","","","","","","","","has coordinates","168534","2020-10-21","18:00:00",""
"4344362","13.872","","14.5501","","9.2221","","96.875","","97.125","","67.398","","1699.87","","","","","","","","","","","","","4","P -1","-P 1","2","","((Fe (C O)3)2 (C O)) (Fe (C O)4)4 Ge2","","- C23 Fe6 Ge2 O23 -","- C23 Fe6 Ge2 O23 -","- C46 Fe12 Ge4 O46 -","2","1","","Anema, S.G.; MacKay, K.M.; Nicholson, B.K.","Characterization of open clusters with linked Ge Fe2 or Sn Fe2 triangles: Structures of Ge2 Fe6 (C O)23, Sn2 Fe6 (C O)23, and Ge2 Fe7 (C O)26","Inorganic Chemistry","1989","28","","3158","3164","","","","","","","","","","","","","","","","","","","","","","has coordinates","168535","2020-10-21","18:00:00",""
"4344364","5.7856","","5.7856","","11.266","","90","","90","","120","","326.586","","","","","","","","","","","","","4","P 3 m 1","P 3 -2""","156","","Na2 In2 (Mo3 O8) (Mo O4)2","","- In2 Mo5 Na2 O16 -","- In2 Mo5 Na2.04 O16 -","- In2 Mo5 Na2.04 O16 -","1","0.166667","","Collins, B.T.; Tsai, P.-P.; Fine, S.M.; Potenza, J.A.; Greenblatt, M.","Crystallographic and magnetic studies of an unusual Mo3 O13 cluster compound, Na2 In2 Mo5 O16","Inorganic Chemistry","1989","28","","2444","2447","","","","","","","","","","","","","","","","","","","","","","has coordinates","168876","2020-10-21","18:00:00",""
"4344368","8.898","","12.434","","12.08","","90","","111.4","","90","","1244.36","","","","","","","","","","","","","3","P 1 21/n 1","-P 2yn","14","","W S Cl4","","- Cl4 S W -","- Cl4 S W -","- Cl32 S8 W8 -","8","2","","Cotton, F.A.; Kibala, P.A.; Sandor, R.B.W.","Synthesis and structural characterization of a new polymorph of tungsten(VI) sulfide tetrachloride, W S Cl4","Inorganic Chemistry","1989","28","","2485","2487","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344375","9.119","","32.019","","9.514","","90","","111.5","","90","","2584.62","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","H (Ru6 (C O)17) B","","- C17 H B O17 Ru6 -","- C17 B O17 Ru6 -","- C68 B4 O68 Ru24 -","4","1","","Hong, F.E.; Coffy, T.J.; McCarthy, D.A.; Shore, S.G.","Synthesis and structure of the ruthenium carbonyl 'boride' cluster H Ru6 (C O)17 B","Inorganic Chemistry","1989","28","","3284","3285","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344377","17.177","","9.846","","12.195","","90","","90.71","","90","","2062.32","","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","Tl4 Re6 Se12","","- Re6 Se12 Tl4 -","- Re6 Se12 Tl4 -","- Re24 Se48 Tl16 -","4","0.5","","Huan, G.; Greaney, M.; Greenblatt, M.; Tsai, P.-P.","Tl4 Re6 X12 (X= S, Se): Crystal growth, structure, and properties","Inorganic Chemistry","1989","28","","2448","2451","","","","","","","","","","","","","","","","","","","","","","has coordinates","169308","2020-10-21","18:00:00",""
"4344378","17.477","","5.384","","21.3","","90","","102.83","","90","","1954.21","","","","","","","","","","","","","3","I 1 2/a 1","-I 2ya","15","","(Xe2 F11)2 (Ni F6)","","- F28 Ni Xe4 -","- F28 Ni Xe4 -","- F112 Ni4 Xe16 -","4","0.5","","Jesih, A.; Lutar, K.; Leban, I.; Zemva, B.","Synthesis and crystal structure of ((Xe2 F11)(+))2 (Ni F6)(2-)","Inorganic Chemistry","1989","28","","2911","2914","","","","","","","","","","","","","","","","","","","","","","has coordinates","206169","2020-10-21","18:00:00",""
"4344388","5.176","","5.176","","13.81","","90","","90","","120","","320.415","","","","","","","","","","","","","4","R 3 c :H","R 3 -2""c","161","","(Li1.2 Cu.8) Ta2 O6","","- Cu0.8 Li1.2 O6 Ta2 -","- Cu0.8 Li1.2 O6 Ta2 -","- Cu2.4 Li3.6 O18 Ta6 -","3","0.166667","","Kumada, N.; Hosoda, S.; Kinomura, N.; Muto, F.","A new lithium insertion compound, (Li, Cu) Ta O3, with the Li Nb O3 type structure","Inorganic Chemistry","1989","28","","3592","3595","","","","","","","","","","","","","","","","","","","","","","has coordinates","169598","2020-10-21","18:00:00",""
"4344485","8.4717","","8.4717","","8.4717","","90","","90","","90","","608.011","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","K2 Na Sc F6","","- F6 K2 Na Sc -","- F6 K2 Na Sc -","- F24 K8 Na4 Sc4 -","4","0.0208333","","Reber, C.; Guedel, H.U.; Meyer, G.; Daul, C.A.; Schleid, T.","Optical spectroscopic and structural properties of V3+ -doped fluoride, chloride, and bromide elpasolite lattices","Inorganic Chemistry","1989","28","","3249","3258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344486","10.4857","","10.4857","","10.4857","","90","","90","","90","","1152.9","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Cs2 Li Y Cl6","","- Cl6 Cs2 Li Y -","- Cl6 Cs2 Li Y -","- Cl24 Cs8 Li4 Y4 -","4","0.0208333","","Reber, C.; Guedel, H.U.; Meyer, G.; Schleid, T.; Daul, C.A.","Optical spectroscopic and structural properties of V3+ -doped fluoride, chloride, and bromide elpasolite lattices","Inorganic Chemistry","1989","28","","3249","3258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344487","10.7396","","10.7396","","10.7396","","90","","90","","90","","1238.69","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Cs2 Na Y Cl6","","- Cl6 Cs2 Na Y -","- Cl6 Cs2 Na Y -","- Cl24 Cs8 Na4 Y4 -","4","0.0208333","","Reber, C.; Guedel, H.U.; Meyer, G.; Schleid, T.; Daul, C.A.","Optical spectroscopic and structural properties of V3+ -doped fluoride, chloride, and bromide elpasolite lattices","Inorganic Chemistry","1989","28","","3249","3258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344488","11.3047","","11.3047","","11.3047","","90","","90","","90","","1444.7","","","","","","","","","","","","","4","F m -3 m","-F 4 2 3","225","","Cs2 Na Y Br6","","- Br6 Cs2 Na Y -","- Br6 Cs2 Na Y -","- Br24 Cs8 Na4 Y4 -","4","0.0208333","","Reber, C.; Guedel, H.U.; Meyer, G.; Schleid, T.; Daul, C.A.","Optical spectroscopic and structural properties of V3+ -doped fluoride, chloride, and bromide elpasolite lattices","Inorganic Chemistry","1989","28","","3249","3258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344489","7.2965","","7.2965","","35.989","","90","","90","","120","","1659.32","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Cs2 Li Sc Cl6","","- Cl6 Cs2 Li Sc -","- Cl6 Cs2 Li Sc -","- Cl36 Cs12 Li6 Sc6 -","6","0.166667","","Reber, C.; Schleid, T.; Guedel, H.U.; Meyer, G.; Daul, C.A.","Optical spectroscopic and structural properties of V3+ -doped fluoride, chloride, and bromide elpasolite lattices","Inorganic Chemistry","1989","28","","3249","3258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344490","7.3184","","7.3184","","36.24","","90","","90","","120","","1680.94","","","","","","","","","","","","","4","R -3 m :H","-R 3 2""","166","","Cs2 Li In Cl6","","- Cl6 Cs2 In Li -","- Cl6 Cs2 In Li -","- Cl36 Cs12 In6 Li6 -","6","0.166667","","Reber, C.; Guedel, H.U.; Schleid, T.; Meyer, G.; Daul, C.A.","Optical spectroscopic and structural properties of V3+ -doped fluoride, chloride, and bromide elpasolite lattices","Inorganic Chemistry","1989","28","","3249","3258","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344494","15.238","","3.8535","","10.156","","90","","118.38","","90","","524.683","","","","","","","","","","","","","3","C 1 2/m 1","-C 2y","12","","Y2 Cl3 N","","- Cl3 N Y2 -","- Cl3 N Y2 -","- Cl12 N4 Y8 -","4","0.5","","Meyer, H.J.; Jones, N.L.; Corbett, J.D.","A new yttrium sesquichloride nitride, beta - Y2 Cl3 N, that is isostructural with the binary yttrium sesquichloride","Inorganic Chemistry","1989","28","","2635","2637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344495","9.085","","6.948","","10.47","","90","","107.27","","90","","631.098","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","(Se6 I) (As F6)","","- As F6 I Se6 -","- As F6 I Se6 -","- As2 F12 I2 Se12 -","2","0.5","","Nandana, W.A.S.; Passmore, J.; White, P.S.; Wong, C.-M.","Preparation and x-ray crystal structure of 1,4-diiodocyclo-hexaselenium bis(hexafluoroarsenate)-bis(sulfur dioxide), Se6 I2 (AS F6)2 (S O2)2, and (Se6 I)n (M F6)n (M= As, Sb)","Inorganic Chemistry","1989","28","","3320","3328","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344496","9.232","","7.025","","10.638","","90","","108.21","","90","","655.372","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","(Se6 I) (Sb F6)","","- F6 I Sb Se6 -","- F6 I Sb Se6 -","- F12 I2 Sb2 Se12 -","2","0.5","","Nandana, W.A.S.; Passmore, J.; White, P.S.; Wong, C.-M.","Preparation and x-ray crystal structure of 1,4-diiodocyclo-hexaselenium bis(hexafluoroarsenate)-bis(sulfur dioxide), Se6 I2 (AS F6)2 (S O2)2, and (Se6 I)n (M F6)n (M= As, Sb)","Inorganic Chemistry","1989","28","","3320","3328","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344497","7.67","","9.454","","7.554","","90.83","","92.9","","88.54","","546.83","","","","","","","","","","","","","4","P -1","-P 1","2","","(Zn2 (H2 O)4) (H P O3)2 (H2 O)","","- H12 O11 P2 Zn2 -","- H12 O11 P2 Zn2 -","- H24 O22 P4 Zn4 -","2","1","","Ortiz-Avila, C.Y.; Clearfield, A.; Squattrito, P.J.; Shieh, M.","Synthesis and chracterization of a new series of zinc phosphites","Inorganic Chemistry","1989","28","","2608","2615","","","","","","","","","","","","","","","","","","","","","","has coordinates","172669","2020-10-21","18:00:00",""
"4344498","8.331","","12.243","","12.669","","90","","90","","90","","1292.19","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","Zn3 Na2 (H P O3)4","","- H4 Na2 O12 P4 Zn3 -","- Na2 O12 P4 Zn3 -","- Na8 O48 P16 Zn12 -","4","0.5","","Ortiz-Avila, C.Y.; Squattrito, P.J.; Shieh, M.; Clearfield, A.","Synthesis and chracterization of a new series of zinc phosphites","Inorganic Chemistry","1989","28","","2608","2615","","","","","","","","","","","","","","","","","","","","","","has coordinates","172671","2020-10-21","18:00:00",""
"4344499","12.373","","13.635","","8.571","","90","","90.24","","90","","1445.96","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Zn3 K2 (H P O3)4","","- H4 K2 O12 P4 Zn3 -","- H4 K2 O12 P4 Zn3 -","- H16 K8 O48 P16 Zn12 -","4","1","","Ortiz-Avila, C.Y.; Squattrito, P.J.; Shieh, M.; Clearfield, A.","Synthesis and chracterization of a new series of zinc phosphites","Inorganic Chemistry","1989","28","","2608","2615","","","","","","","","","","","","","","","","","","","","","","has coordinates","172673","2020-10-21","18:00:00",""
"4344500","22.707","","5.302","","15.029","","90","","105.278","","90","","1745.43","","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","15","","(Zn3 (H2 O)6) Ba (H P O3)4","","- Ba H16 O18 P4 Zn3 -","- Ba H14 O18 P4 Zn3 -","- Ba4 H56 O72 P16 Zn12 -","4","0.5","","Ortiz-Avila, C.Y.; Shieh, M.; Squattrito, P.J.; Clearfield, A.","Synthesis and chracterization of a new series of zinc phosphites","Inorganic Chemistry","1989","28","","2608","2615","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""