# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T18:43:19+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 = 22 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
"4344227","17.938","","13.395","","21.448","","90","","90","","90","","5153.52","","","","","","","","","","","","","6","P n a 21","P 2c -2n","33","","Cs5 N H4 (W4 O8 (N C S)12) (H2 O)6","","- C12 Cs5 N13 O10 S12 W4 -","- C12 Cs5 N13 O10 S12 W4 -","- C48 Cs20 N52 O40 S48 W16 -","4","1","","Launay, J.P.; Jeannin, Y.P.; Nel, A.","Substitution Derivatives of the Mixed-Valence (W4 O8 Cl8 (H2 O)4)(2-)-Ion. Crystal and Molecular Structure of Cs5 N H4 (W4 O8 (N C S)12) (H2 O)6","Inorganic Chemistry","1983","22","","277","281","","","","","","","","","","","","","","","","","","","","","","has coordinates","161191","2020-10-21","18:00:00",""
"4344244","6.053","","6.09","","13.797","","84.53","","87.48","","81.56","","500.565","","","","","","","","","","","","","5","P -1","-P 1","2","","Cl4 W N Te F5","","- Cl4 F5 N Te W -","- Cl4 F5 N Te W -","- Cl8 F10 N2 Te2 W2 -","2","1","","Hartl, H.; Huppmann, P.; Seppelt, K.; Lentz, D.","Tellurium-Nitrogen Compounds","Inorganic Chemistry","1983","22","","2183","2187","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344246","9.565","","9.3077","","9.2813","","90","","116.44","","90","","739.867","","","","","","","","","","","","","5","P 1 21/c 1","-P 2ybc","14","","Cs2 (Ti Cl2 (H2 O)4) Cl3","","- Cl5 Cs2 H8 O4 Ti -","- Cl5 Cs2 O4 Ti -","- Cl10 Cs4 O8 Ti2 -","2","0.5","","McCarthy, P.J.; Richardson, M.F.","Crystal Structure and Low-Temperature Crystal Spectra of Dicesium trans-Dichlorotetraaquotitanium(III) Chloride","Inorganic Chemistry","1983","22","","2979","2982","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344251","14.445","","14.034","","12.725","","90","","90","","90","","2579.63","","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","I Br2 Sb2 F11","","- Br2 F11 I Sb2 -","- Br2 F11 I Sb2 -","- Br16 F88 I8 Sb16 -","8","1","","Birchall, T.; Myers, R.D.","Preparation of (I Br2) (Sb2 F11) and (I Br.75 Cl1.25) (Sb Cl6). Their Characterization by X-ray Crystallography and Raman Spectroscopy","Inorganic Chemistry","1983","22","","1751","1756","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344252","7.084","","6.299","","13.511","","94.5","","100.32","","92.56","","590.247","","","","","","","","","","","","","4","P -1","-P 1","2","","I Br.75 Cl1.25 (Sb Cl6)","","- Br0.75 Cl7.25 I Sb -","- Br0.74 Cl7.24 I Sb -","- Br1.48 Cl14.48 I2 Sb2 -","2","1","","Birchall, T.; Myers, R.D.","Preparation of (I Br2) (Sb2 F11) and (I Br.75 Cl1.25) (Sb Cl6). Their Characterization by X-ray Crystallography and Raman Spectroscopy","Inorganic Chemistry","1983","22","","1751","1756","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344254","11.084","","16.992","","17.387","","90","","90","","90","","3274.66","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","Bi6 O4 (O H)4 (Cl O4)6 (H2 O)7","","- Bi6 Cl6 H18 O39 -","- Bi6 Cl6 H18 O39 -","- Bi24 Cl24 H72 O156 -","4","1","","Sundvall, B.","Crystal Structure of Tetraoxotetrahydroxohexabismuth(III) Perchlorate Heptahydrate, Bi6 O4 (H O)4 (Cl O4)6 (H2 O)7: An X-ray and Neutron Diffraction Study","Inorganic Chemistry","1983","22","","1906","1912","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344267","13.621","","12.839","","13.954","","90","","90","","90","","2440.28","","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","(Cr (N H3)4 O H)2 (S2 O6)2 (H2 O)4","","- Cr2 H34 N8 O18 S4 -","- Cr2 H34 N8 O18 S4 -","- Cr8 H136 N32 O72 S16 -","4","0.5","","Cline, S.J.; Larsen, S.; Hodgson, D.J.; Pedersen, E.; Kallesoe, S.","Low-Temperature Structural and Magnetic Characterization of the Chromium(III) Dimers Bis(mue-hydroxo)bis(tetraamminechromium(III))Dithionate Tetrahydrate and Bis(mue-hydroxo)bis(tetraamminechromium(III))Chloride Tetrahydrate,(Cr(N H3)...","Inorganic Chemistry","1983","22","","637","642","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344269","10.678","","10.005","","9.351","","90","","98.6","","90","","987.767","","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","(Cr (N H3)4 O H)2 Cl4 (H2 O)4","","- Cl4 Cr2 H34 N8 O6 -","- Cl4 Cr2 H34 N8 O6 -","- Cl8 Cr4 H68 N16 O12 -","2","0.5","","Cline, S.J.; Hodgson, D.J.; Kallesoe, S.; Larsen, S.; Pedersen, E.","Low-Temperature Structural and Magnetic Characterization of the Chromium(III) Dimers Bis(mue-hydroxo)bis(tetraamminechromium(III))Dithionate Tetrahydrate and Bis(mue-hydroxo)bis(tetraamminechromium(III))Chloride Tetrahydrate,(Cr(N H3)...","Inorganic Chemistry","1983","22","","637","642","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344284","13.725","","5.672","","11.092","","90","","90","","90","","863.492","","","","","","","","","","","","","3","P b c n","-P 2n 2ab","60","","Mo Fe2 P12","","- Fe2 Mo P12 -","- Fe2 Mo P12 -","- Fe8 Mo4 P48 -","4","0.5","","Floerke, U.; Jeitschko, W.","Preparation, physical properties, and crystal structure of Mo Fe2 P12 and W Fe2 P12","Inorganic Chemistry","1983","22","","1736","1739","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344286","8.442","","13.106","","10.997","","90","","101.47","","90","","1192.42","","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","Zn (S (N S O)2)2 (As F6)2 (S O2)2","","- As2 F12 N4 O8 S8 Zn -","- As2 F11.9992 N4 O8 S8 Zn -","- As4 F23.9984 N8 O16 S16 Zn2 -","2","0.5","","Roesky, H.W.; Thomas, M.; Fuess, H.; Bats, J.W.","Preparation and crystal structure of Zn (S (N S O)2)2 (As F6)2 (S O2)2: a compound with a two-dimensional network through oxygen atoms","Inorganic Chemistry","1983","22","","2342","2343","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9012512","5.036","","5.036","","11.255","","90","","90","","120","","247.199","","","","","","","","","","","","Synthetic","3","P 31 2 1","P 31 2""","152","","","Rodolicoite","- Fe O4 P -","- Fe O4 P -","- Fe3 O12 P3 -","3","0.5","","Long, G. J.; Cheetham, A. K.; Battle, P. D.","Study of the iron-phosphorus-oxygen system by Mossbauer effect, neutron diffraction, magnetic susceptibility, and analytical electron microscopy: some pitfalls and solutions in the analysis of a complex mixture","Inorganic Chemistry","1983","22","","3012","3016","10.1021/ic00163a007","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""