# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T20:07:25+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 'Chemische Berichte') AND volume = 129 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
"1100424","8.724","0.003","11.463","0.001","14.777","0.002","108.12","","103.99","","99.47","","1315.96","","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C30 H33 B Cr O3 -","- C30 H33 B Cr O3 -","- C60 H66 B2 Cr2 O6 -","2","1","","Elschenbroich, Christoph; Kühlkamp, Peter; Behrendt, Andreas; Harms, Klaus","Metall-π-Komplexe von Benzolderivaten, 49. Halbsandwichkomplexe des Trimesitylborans Mes~3~B: Darstellung und Struktur von Mes~2~B[(η^6^-Mes)Cr(CO)~3~], MesB[(η^6^-Mes)Cr(CO)~3~]~2~ und B[(η^6^-Mes)Cr(CO)~3~]~3~. Redoxverhalten und Fragen der intramolekularen Wechselwirkung","Chemische Berichte","1996","129","7","859","869","10.1002/cber.19961290720","","","","","","","","","","","","","","","","","","","","","has coordinates","177579","2020-10-21","18:00:00",""
"1100425","33.631","0.007","12.174","0.002","15.285","0.003","90","","90","","90","","6258.04","","","","","","","","","","","","","5","P b c n","-P 2n 2ab","60","","","","- C33 H33 B Cr2 O6 -","- C33 H33 B Cr2 O6 -","- C264 H264 B8 Cr16 O48 -","8","1","","Elschenbroich, Christoph; Kühlkamp, Peter; Behrendt, Andreas; Harms, Klaus","Metall-π-Komplexe von Benzolderivaten, 49. Halbsandwichkomplexe des Trimesitylborans Mes~3~B: Darstellung und Struktur von Mes~2~B[(η^6^-Mes)Cr(CO)~3~], MesB[(η^6^-Mes)Cr(CO)~3~]~2~ und B[(η^6^-Mes)Cr(CO)~3~]~3~. Redoxverhalten und Fragen der intramolekularen Wechselwirkung","Chemische Berichte","1996","129","7","859","869","10.1002/cber.19961290720","","","","","","","","","","","","","","","","","","","","","has coordinates","177579","2020-10-21","18:00:00",""
"1100426","16.151","0.002","16.151","0.002","8.203","0.002","90","","90","","120","","1853.11","","","","","","","","","","","","","5","P -3","-P 3","147","","","","- C36 H33 B Cr3 O9 -","- C112 H99 B Cr9 O27 -","- C224 H198 B2 Cr18 O54 -","2","0.333333","","Elschenbroich, Christoph; Kühlkamp, Peter; Behrendt, Andreas; Harms, Klaus","Metall-π-Komplexe von Benzolderivaten, 49. Halbsandwichkomplexe des Trimesitylborans Mes~3~B: Darstellung und Struktur von Mes~2~B[(η^6^-Mes)Cr(CO)~3~], MesB[(η^6^-Mes)Cr(CO)~3~]~2~ und B[(η^6^-Mes)Cr(CO)~3~]~3~. Redoxverhalten und Fragen der intramolekularen Wechselwirkung","Chemische Berichte","1996","129","7","859","869","10.1002/cber.19961290720","","","","","","","","","","","","","","","","","","","","","has coordinates","177579","2020-10-21","18:00:00",""
"1100465","11.129","0.001","19.133","0.002","10.41","0.001","90","","90","","90","","2216.61","","","","","","","","","","","","","5","P 21 21 2","P 2 2ab","18","","","","- C28 H72 N4 P4 Zn4 -","- C56 H144 N8 P8 Zn8 -","- C112 H288 N16 P16 Zn16 -","2","0.5","","Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Parsons, Simon; Dehnicke, Kurt","Zinkorganische Phosphaniminato-Komplexe mit Heterocuban-Struktur","Chemische Berichte","1996","129","12","1621","1625","10.1002/cber.19961291232","","","","","","","","","","","","","","","","","","","","","has coordinates","177580","2020-10-21","18:00:00",""
"1100466","11.8556","0.0007","16.3583","0.0011","16.552","0.002","90","","90","","90","","3210.05","","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- C16 H48 N4 P4 Zn4 -","- C28 H96 N6 P6 Zn6 -","- C112 H384 N24 P24 Zn24 -","4","0.5","","Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Parsons, Simon; Dehnicke, Kurt","Zinkorganische Phosphaniminato-Komplexe mit Heterocuban-Struktur","Chemische Berichte","1996","129","12","1621","1625","10.1002/cber.19961291232","","","","","","","","","","","","","","","","","","","","","has coordinates","177580","2020-10-21","18:00:00",""
"1100467","12.4","0.003","17.808","0.004","18.723","0.004","90","","106.02","0.03","90","","3973.84","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C25 H63 I N3 P3 Zn4 -","- C25 H63 I N3 P3 Zn4 -","- C100 H252 I4 N12 P12 Zn16 -","4","1","","Krieger, Matthias; Gould, Robert O.; Harms, Klaus; Parsons, Simon; Dehnicke, Kurt","Zinkorganische Phosphaniminato-Komplexe mit Heterocuban-Struktur","Chemische Berichte","1996","129","12","1621","1625","10.1002/cber.19961291232","","","","","","","","","","","","","","","","","","","","","has coordinates","177580","2020-10-21","18:00:00",""
"1100491","10.689","0.002","13.204","0.002","23.792","0.004","90","","94.85","0.01","90","","3345.92","","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","14","","","","- C6 H18 As2 Cl4 N2 P2 -","- C6 H18 As2 Cl4 N2 P2 -","- C48 H144 As16 Cl32 N16 P16 -","8","2","","Garbe, Ralf; Wocadlo, Sigrid; Kang, Hak-Chul; Massa, Werner; Harms, Klaus; Dehnicke, Kurt","Phosphaniminato-Komplexe des Arsens. Kristallstrukturen von [AsCl(NPMe~3~)]~2~Cl~2~, [AsCl(NPMe~3~)~2~SbCl~4~]SbCl~6~ und [AsCl(NPMe~3~)~2~SnCl~4~] · CH~3~CN","Chemische Berichte","1996","129","1","109","113","10.1002/cber.19961290120","","","","","","","","","","","","","","","","","","","","","has coordinates","177576","2020-10-21","18:00:00",""
"1100492","26.667","0.006","7.921","0.003","25.604","0.002","90","","95.84","0.01","90","","5380.25","","","","","","","","","","","","","7","C 1 2/c 1","-C 2yc","15","","","","- C6 H18 As Cl11 N2 P2 Sb2 -","- C6 As Cl11 N2 P2 Sb2 -","- C48 As8 Cl88 N16 P16 Sb16 -","8","1","","Garbe, Ralf; Wocadlo, Sigrid; Kang, Hak-Chul; Massa, Werner; Harms, Klaus; Dehnicke, Kurt","Phosphaniminato-Komplexe des Arsens. Kristallstrukturen von [AsCl(NPMe~3~)]~2~Cl~2~, [AsCl(NPMe~3~)~2~SbCl~4~]SbCl~6~ und [AsCl(NPMe~3~)~2~SnCl~4~] · CH~3~CN","Chemische Berichte","1996","129","1","109","113","10.1002/cber.19961290120","","","","","","","","","","","","","","","","","","","","","has coordinates","177576","2020-10-21","18:00:00",""
"1100493","8.895","0.002","14.233","0.001","17.012","0.001","90","","102.59","0.01","90","","2101.97","","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C8 H21 As Cl5 N3 P2 Sn -","- C8 H21 As Cl5 N3 P2 Sn -","- C32 H84 As4 Cl20 N12 P8 Sn4 -","4","1","","Garbe, Ralf; Wocadlo, Sigrid; Kang, Hak-Chul; Massa, Werner; Harms, Klaus; Dehnicke, Kurt","Phosphaniminato-Komplexe des Arsens. Kristallstrukturen von [AsCl(NPMe~3~)]~2~Cl~2~, [AsCl(NPMe~3~)~2~SbCl~4~]SbCl~6~ und [AsCl(NPMe~3~)~2~SnCl~4~] · CH~3~CN","Chemische Berichte","1996","129","1","109","113","10.1002/cber.19961290120","","","","","","","","","","","","","","","","","","","","","has coordinates","177576","2020-10-21","18:00:00",""
"1100494","16.798","0.001","16.798","0.001","8.997","0.001","90","","90","","90","","2538.71","","","","","","","","","","","","","5","P 4/n :2","-P 4a","85","","","","- C56 H40 Cl I4 P -","- C56 Cl I4 P -","- C112 Cl2 I8 P2 -","2","0.25","","Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt","Komplexe von Halogenid-Ionen mit 1-Halogen-2-phenylacetylenen. Kristallstrukturen von PPh~4~[X(I‒C≡C‒Ph)~4~] mit X = Cl, Br, I, von PPh~4~[Br(Br‒C≡C‒Ph)~4~] und von NMe~4~[F(I‒C≡C‒Ph)~2~]","Chemische Berichte","1996","129","1","115","120","10.1002/cber.19961290121","","","","","","","","","","","","","","","","","","","","","has coordinates","177577","2020-10-21","18:00:00",""
"1100495","16.807","0.001","16.807","0.001","9.015","0.001","90","","90","","90","","2546.51","","","","","","","","","","","","","5","P 4/n :2","-P 4a","85","","","","- C56 H40 Br I4 P -","- C56 H40 Br I4 P -","- C112 H80 Br2 I8 P2 -","2","0.25","","Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt","Komplexe von Halogenid-Ionen mit 1-Halogen-2-phenylacetylenen. Kristallstrukturen von PPh~4~[X(I‒C≡C‒Ph)~4~] mit X = Cl, Br, I, von PPh~4~[Br(Br‒C≡C‒Ph)~4~] und von NMe~4~[F(I‒C≡C‒Ph)~2~]","Chemische Berichte","1996","129","1","115","120","10.1002/cber.19961290121","","","","","","","","","","","","","","","","","","","","","has coordinates","177577","2020-10-21","18:00:00",""
"1100496","17.02","0.01","17.02","0.01","9.881","0.001","90","","90","","90","","2862.33","","","","","","","","","","","","","4","P 4/n :2","-P 4a","85","","","","- C56 H40 I5 P -","- C56 H40 I5 P -","- C112 H80 I10 P2 -","2","0.25","","Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt","Komplexe von Halogenid-Ionen mit 1-Halogen-2-phenylacetylenen. Kristallstrukturen von PPh~4~[X(I‒C≡C‒Ph)~4~] mit X = Cl, Br, I, von PPh~4~[Br(Br‒C≡C‒Ph)~4~] und von NMe~4~[F(I‒C≡C‒Ph)~2~]","Chemische Berichte","1996","129","1","115","120","10.1002/cber.19961290121","","","","","","","","","","","","","","","","","","","","","has coordinates","177577","2020-10-21","18:00:00",""
"1100497","15.383","0.004","8.53","0.002","18.636","0.003","90","","95.24","0.02","90","","2435.14","","","","","","","","","","","","","4","P 1 2/n 1","-P 2yac","13","","","","- C56 H40 Br5 P -","- C56 H40 Br5 P -","- C112 H80 Br10 P2 -","2","0.5","","Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt","Komplexe von Halogenid-Ionen mit 1-Halogen-2-phenylacetylenen. Kristallstrukturen von PPh~4~[X(I‒C≡C‒Ph)~4~] mit X = Cl, Br, I, von PPh~4~[Br(Br‒C≡C‒Ph)~4~] und von NMe~4~[F(I‒C≡C‒Ph)~2~]","Chemische Berichte","1996","129","1","115","120","10.1002/cber.19961290121","","","","","","","","","","","","","","","","","","","","","has coordinates","177577","2020-10-21","18:00:00",""
"1100498","7.25","0.001","10.093","0.001","15.337","0.002","90","","100.21","0.01","90","","1104.5","","","","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C20 H22 F I2 N -","- C20 H22 F I2 N -","- C40 H44 F2 I4 N2 -","2","1","","Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt","Komplexe von Halogenid-Ionen mit 1-Halogen-2-phenylacetylenen. Kristallstrukturen von PPh~4~[X(I‒C≡C‒Ph)~4~] mit X = Cl, Br, I, von PPh~4~[Br(Br‒C≡C‒Ph)~4~] und von NMe~4~[F(I‒C≡C‒Ph)~2~]","Chemische Berichte","1996","129","1","115","120","10.1002/cber.19961290121","","","","","","","","","","","","","","","","","","","","","has coordinates","177577","2020-10-21","18:00:00",""
"1100499","14.434","0.001","14.434","0.001","7.147","0.001","90","","90","","90","","1489.01","","","","","","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C28 H20 Cl I4 P -","- C28 H20 Cl I4 P -","- C56 H40 Cl2 I8 P2 -","2","0.25","","Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt","Komplexe von Halogenid-Ionen mit Diiodacetylen. Die Kristallstrukturen von PPh~4~[X(I-C≡C-I)~2~] mit X = Cl, Br, I","Chemische Berichte","1996","129","2","259","262","10.1002/cber.19961290224","","","","","","","","","","","","","","","","","","","","","has coordinates","177578","2020-10-21","18:00:00",""
"1100500","14.499","0.001","14.499","0.001","7.167","0.001","90","","90","","90","","1506.65","","","","","","","","","","","","","5","P -4 21 m","P -4 2ab","113","","","","- C28 H20 Br I4 P -","- C28 H20 Br I4 P -","- C56 H40 Br2 I8 P2 -","2","0.25","","Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt","Komplexe von Halogenid-Ionen mit Diiodacetylen. Die Kristallstrukturen von PPh~4~[X(I-C≡C-I)~2~] mit X = Cl, Br, I","Chemische Berichte","1996","129","2","259","262","10.1002/cber.19961290224","","","","","","","","","","","","","","","","","","","","","has coordinates","177578","2020-10-21","18:00:00",""
"1100501","14.618","0.007","14.618","0.007","7.123","0.006","90","","90","","90","","1522.08","","","","","","","","","","","","","4","P -4 21 m","P -4 2ab","113","","","","- C28 H20 I5 P -","- C28 H20 I5 P -","- C56 H40 I10 P2 -","2","0.25","","Ghassemzadeh, Mitra; Harms, Klaus; Dehnicke, Kurt","Komplexe von Halogenid-Ionen mit Diiodacetylen. Die Kristallstrukturen von PPh~4~[X(I-C≡C-I)~2~] mit X = Cl, Br, I","Chemische Berichte","1996","129","2","259","262","10.1002/cber.19961290224","","","","","","","","","","","","","","","","","","","","","has coordinates","177578","2020-10-21","18:00:00",""
"1509426","5.807","","12.939","","22.296","","90","","90","","90","","1675.25","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","K2 (Ag V S4)","","- Ag K2 S4 V -","- Ag K2 S4 V -","- Ag8 K16 S32 V8 -","8","0.25","","Duerichen, P.; Bensch, W.","Crystal structure and preparation of K2 Ag V S4 and Rb2 Ag V S4 by using the molten flux method: Low-dimensional materials with infinite metal-ion-centered tetrahedra chains","Chemische Berichte","1996","129","","1207","1210","10.1002/cber.19961291011","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509519","5.82","","13.359","","23.184","","90","","90","","90","","1802.54","","","","","","","","","","","","","4","F d d d :2","-F 2uv 2vw","70","","Rb2 (Ag V S4)","","- Ag Rb2 S4 V -","- Ag Rb2 S4 V -","- Ag8 Rb16 S32 V8 -","8","0.25","","Bensch, W.; Duerichen, P.","Crystal structure and preparation of K2 Ag V S4 and Rb2 Ag V S4 by using the molten flux method: Low-dimensional materials with infinite metal-ion-centered tetrahedra chains","Chemische Berichte","1996","129","","1207","1210","10.1002/cber.19961291011","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""