Crystallography Open Database

Result: there are 174 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)

Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials' volume of publication is 71

Blue left arrow Blue left arrow First | Blue left arrow Previous 20 | of 9 | Next 20 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Blue up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Up arrow Bibliography
2020872 CIF
HKL
Paper
C16 H24 Br4 Cu N2P -18.0517; 9.3247; 16.4524
75.997; 88.567; 65.757
1088.97Kelley, Annette; Nalla, Sowjanya; Bond, Marcus R.
The square-planar to flattened-tetrahedral CuX42−(X= Cl, Br) structural phase transition in 1,2,6-trimethylpyridinium salts
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 48-60
2020873 CIF
HKL
Paper
C16 H24 Cl4 Cu N2C 1 2/m 112.9074; 9.2262; 8.6377
90; 114.925; 90
932.82Kelley, Annette; Nalla, Sowjanya; Bond, Marcus R.
The square-planar to flattened-tetrahedral CuX42−(X= Cl, Br) structural phase transition in 1,2,6-trimethylpyridinium salts
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 48-60
2020874 CIF
HKL
Paper
C16 H24 Cl4 Cu N2C 1 2/m 113.191; 9.2068; 8.7242
90; 114.595; 90
963.4Kelley, Annette; Nalla, Sowjanya; Bond, Marcus R.
The square-planar to flattened-tetrahedral CuX42−(X= Cl, Br) structural phase transition in 1,2,6-trimethylpyridinium salts
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 48-60
2020875 CIF
HKL
Paper
C16 H24 Cl4 Cu N2P -17.9236; 9.1502; 16.1341
75.409; 86.964; 64.493
1019.63Kelley, Annette; Nalla, Sowjanya; Bond, Marcus R.
The square-planar to flattened-tetrahedral CuX42−(X= Cl, Br) structural phase transition in 1,2,6-trimethylpyridinium salts
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 48-60
2020876 CIF
HKL
Paper
C18 H28 Cl4 Cu N2P 1 21/c 16.4234; 22.4819; 8.4552
90; 116.314; 90
1094.49Kelley, Annette; Nalla, Sowjanya; Bond, Marcus R.
The square-planar to flattened-tetrahedral CuX42−(X= Cl, Br) structural phase transition in 1,2,6-trimethylpyridinium salts
Acta Crystallographica Section B Structural Science, Crystal Engineering and Materials, 2015, 71, 48-60
2105998 CIF
Paper
C16 H16P -4 n 27.6726; 7.6726; 9.191
90; 90; 90
541.063Wolf, Hilke; Jørgensen, Mads R. V.; Chen, Yu-Sheng; Herbst-Irmer, Regine; Stalke, Dietmar
Charge density investigations on [2,2]-paracyclophane ‒ in data we trust
Acta Crystallographica Section B, 2015, 71
2105999 CIF
HKL
C16 H16P -4 n 27.6619; 7.6619; 9.183
90; 90; 90
539.085Wolf, Hilke; Jørgensen, Mads R. V.; Chen, Yu-Sheng; Herbst-Irmer, Regine; Stalke, Dietmar
Charge density investigations on [2,2]-paracyclophane ‒ in data we trust
Acta Crystallographica Section B, 2015, 71
2106000 CIFC16 H16P -4 n 27.6761; 7.6761; 9.1966
90; 90; 90
541.887Wolf, Hilke; Jørgensen, Mads R. V.; Chen, Yu-Sheng; Herbst-Irmer, Regine; Stalke, Dietmar
Charge density investigations on [2,2]-paracyclophane ‒ in data we trust
Acta Crystallographica Section B, 2015, 71
2106001 CIF
HKL
C16 H16P -4 n 27.6648; 7.6648; 9.1858
90; 90; 90
539.658Wolf, Hilke; Jørgensen, Mads R. V.; Chen, Yu-Sheng; Herbst-Irmer, Regine; Stalke, Dietmar
Charge density investigations on [2,2]-paracyclophane ‒ in data we trust
Acta Crystallographica Section B, 2015, 71
2106002 CIF
HKL
Paper
C4 H12 Cl4 Co N2P 21 21 218.2876; 11.1324; 11.9121
90; 90; 90
1099.02Decaroli, C.; Arevalo-Lopez, A. M.; Woodall, C. H.; Rodriguez, E. E.; Attfield, J. P.; Parker, S. F.; Stock, C.
(C~4~H~12~N~2~)[CoCl~4~]: tetrahedrally coordinated Co^2+^ without the orbital degeneracy
Acta Crystallographica Section B, 2015, 71
2106003 CIFC34 H50 O7P 1 21 17.476; 35.981; 11.359
90; 90.944; 90
3055.09Tykarska, Ewa; Gdaniec, Maria
Solid-state supramolecular architecture of carbenoxolone ‒ comparative studies with glycyrrhetinic and glycyrrhizic acids
Acta Crystallographica Section B, 2015, 71
2106004 CIF
HKL
C37 H56 O9P 1 21 113.064; 7.319; 18.617
90; 103.515; 90
1730.78Tykarska, Ewa; Gdaniec, Maria
Solid-state supramolecular architecture of carbenoxolone ‒ comparative studies with glycyrrhetinic and glycyrrhizic acids
Acta Crystallographica Section B, 2015, 71
2106005 CIF
HKL
C38 H60 O9P 21 21 217.2834; 11.6425; 41.9069
90; 90; 90
3553.58Tykarska, Ewa; Gdaniec, Maria
Solid-state supramolecular architecture of carbenoxolone ‒ comparative studies with glycyrrhetinic and glycyrrhizic acids
Acta Crystallographica Section B, 2015, 71
2106006 CIF
HKL
C76 H119 Na O18P 1 21 17.3497; 11.8061; 42.4208
90; 92.476; 90
3677.47Tykarska, Ewa; Gdaniec, Maria
Solid-state supramolecular architecture of carbenoxolone ‒ comparative studies with glycyrrhetinic and glycyrrhizic acids
Acta Crystallographica Section B, 2015, 71
2106007 CIF
Paper
C11 H8 O3P 1 21/n 16.9798; 3.8107; 32.79
90; 93.901; 90
870.1Zhang, Qi; Li, Meiqi; Mei, Xuefeng
A new polymorph of 1-hydroxy-2-naphthoic acid obtained during failed co-crystallization experiments
Acta Crystallographica Section B, 2015, 71
2106008 CIFC11 H8 O3C 1 2/c 120.92; 6.9926; 14.688
90; 125.339; 90
1752.7Zhang, Qi; Li, Meiqi; Mei, Xuefeng
A new polymorph of 1-hydroxy-2-naphthoic acid obtained during failed co-crystallization experiments
Acta Crystallographica Section B, 2015, 71
2106009 CIF
HKL
Paper
Mo2.603 Nd4.365 O16.47 Pb0.335P n -3 n :111.0421; 11.0421; 11.0421
90; 90; 90
1346.3Antipin, Alexander M.; Sorokina, Natalia I.; Alekseeva, Olga A.; Kuskova, Alexandra N.; Kharitonova, Elena P.; Orlova, Ekaterina I.; Voronkova, Valentina I.
Structure of fluorite-like compound based on Nd~5~Mo~3~O~16~ with lead partly substituting for neodymium
Acta Crystallographica Section B, 2015, 71
2106010 CIF
Paper
Ba O6.84 Si2 TiP 1 21/n 17.98355; 10.0084; 7.47952
90; 100.321; 90
587.96Viani, Alberto; Palermo, Andrea; Zanardi, Stefano; Demitri, Nicola; Petrícek, Václav; Varini, Federico; Belluso, Elena; Ståhl, Kenny; Gualtieri, Alessandro Francesco
Structure and stability of BaTiSi~2~O~7~
Acta Crystallographica Section B, 2015, 71
2106011 CIF
Paper
Ba O7 Si2 TiP -17.99385; 10.01017; 7.47514
90.0836; 100.368; 89.9368
588.392Viani, Alberto; Palermo, Andrea; Zanardi, Stefano; Demitri, Nicola; Petrícek, Václav; Varini, Federico; Belluso, Elena; Ståhl, Kenny; Gualtieri, Alessandro Francesco
Structure and stability of BaTiSi~2~O~7~
Acta Crystallographica Section B, 2015, 71
2106012 CIF
Paper
C18 H30 Cl N9 O5P -19.445; 10.3974; 13.3661
77.188; 89.846; 67.043
1173.4Gerhardt, Valeska; Egert, Ernst
Cocrystals of 6-chlorouracil and 6-chloro-3-methyluracil: exploring their hydrogen-bond-based synthon motifs with several triazine and pyrimidine derivatives
Acta Crystallographica Section B, 2015, 71, 209-220

Blue left arrow Blue left arrow First | Blue left arrow Previous 20 | of 9 | Next 20 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!