Crystallography Open Database

Result: there are 390 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 B (39,1983-)' volume of publication is 63

Blue left arrow Blue left arrow First | Blue left arrow Previous 50 | of 8 | Next 50 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
2102926 CIF
Paper
Al11 Co6 Si6P 1 21/c 18.0839; 21.3536; 8.32
90; 119.07; 90
1255.28Richter, Klaus W.; Prots, Yurii; Borrmann, Horst; Ramlau, Reiner; Grin, Yuri
Crystal structure and local order in Co~6~Al~11{-~<i>x</i>}Si~6+<i>x~</i>
Acta Crystallographica Section B, 2007, 63, 551-560
2102927 CIF
Paper
C4 Br4 SP c a 2112.6516; 4.0373; 16.3456
90; 90; 90
834.9Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René
Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing
Acta Crystallographica Section B, 2007, 63, 783-790
2102928 CIF
Paper
C4 Br4 SP c a 2112.6511; 4.0371; 16.3449
90; 90; 90
834.79Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René
Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing
Acta Crystallographica Section B, 2007, 63, 783-790
2102929 CIF
Paper
C4 Br4 SP c a 2112.6482; 4.0362; 16.3411
90; 90; 90
834.22Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René
Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing
Acta Crystallographica Section B, 2007, 63, 783-790
2102930 CIF
Paper
C4 Br4 SeP 1 21/c 114.86453; 4.078983; 13.90429
90; 96.3502; 90
837.875Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René
Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing
Acta Crystallographica Section B, 2007, 63, 783-790
2102931 CIF
Paper
C4 Br4 SP 1 n 112.419; 4.0397; 8.824
90; 109.181; 90
418.1Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René
Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing
Acta Crystallographica Section B, 2007, 63, 783-790
2102932 CIF
Paper
C4 Br4 SP c a 2112.643; 4.034; 16.35
90; 90; 90
833.8Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René
Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing
Acta Crystallographica Section B, 2007, 63, 783-790
2102933 CIF
Paper
C4 Br4 SP c a 2112.5599; 3.9973; 16.3267
90; 90; 90
819.69Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René
Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing
Acta Crystallographica Section B, 2007, 63, 783-790
2102934 CIF
Paper
C4 Br4 SP 1 n 112.376; 4.004; 8.816
90; 109.452; 90
411.9Helmholdt, Robert B.; Sonneveld, Ed J.; Vande Velde, Christophe M. L.; Blockhuys, Frank; Lenstra, Albert T. H.; Geise, Herman J.; Peschar, René
Structures of tetrabromothiophene and tetrabromoselenophene: the influence of the heteroatom on the heterophene packing
Acta Crystallographica Section B, 2007, 63, 783-790
2102935 CIF
Paper
Ag18.56 Li33.44I -4 3 m9.6066; 9.6066; 9.6066
90; 90; 90
886.56Tatsuo, Noritake; Masakazu, Aoki; Shin-ich, Towata; Tsunehiro, Takeuchi; Uichiro, Mizutani
Structure determination of structurally complex Ag~36~Li~64~ gamma-brass
Acta Crystallographica Section B, 2007, 63, 726-734
2102936 CIF
Paper
Fe O2 RbP b c a5.7568; 11.5136; 16.2827
90; 90; 90
1079.2Nuss, Jürgen; Ali, Naveed Zafar; Jansen, Martin
Structure of RbFeO~2~, refined from a reticular pseudomerohedrally twinned crystal with six domains
Acta Crystallographica Section B, 2007, 63, 719-725
2102937 CIF
Paper
C8 H24 I4 N2 PbP b c a8.428; 8.986; 26.233
90; 90; 90
1986.7Billing, David G.; Lemmerer, Andreas
Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6
Acta Crystallographica Section B, 2007, 63, 735-747
2102938 CIF
Paper
C8 H24 I4 N2 PbP b c a8.8764; 8.6925; 27.6014
90; 90; 90
2129.67Billing, David G.; Lemmerer, Andreas
Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6
Acta Crystallographica Section B, 2007, 63, 735-747
2102939 CIF
Paper
C10 H28 I4 N2 PbP 1 21/a 18.4716; 9.007; 14.784
90; 100.881; 90
1107.8Billing, David G.; Lemmerer, Andreas
Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6
Acta Crystallographica Section B, 2007, 63, 735-747
2102940 CIF
Paper
C10 H28 I4 N2 PbP 1 21/a 18.6716; 8.9297; 14.8805
90; 100.212; 90
1134.01Billing, David G.; Lemmerer, Andreas
Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6
Acta Crystallographica Section B, 2007, 63, 735-747
2102941 CIF
Paper
C10 H28 I4 N2 PbP b c a9.0078; 8.731; 29.956
90; 90; 90
2356Billing, David G.; Lemmerer, Andreas
Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6
Acta Crystallographica Section B, 2007, 63, 735-747
2102942 CIF
Paper
C12 H32 I4 N2 PbP 1 21/a 18.643; 8.845; 16.052
90; 91.985; 90
1226.4Billing, David G.; Lemmerer, Andreas
Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6
Acta Crystallographica Section B, 2007, 63, 735-747
2102943 CIF
Paper
C12 H32 I4 N2 PbP b c a8.9413; 8.6874; 32.7027
90; 90; 90
2540.24Billing, David G.; Lemmerer, Andreas
Synthesis, characterization and phase transitions in the inorganic‒organic layered perovskite-type hybrids [(C~<i>n~</i>H~2<i>n~+1</i>NH~3~)~2~PbI~4~], <i>n</i> = 4, 5 and 6
Acta Crystallographica Section B, 2007, 63, 735-747
2102944 CIF
Paper
Fe0.91 S(000 ???6.892; 11.952; 5.744
90; 90; 90
473.15Izaola, Zunbeltz; González, Santiago; Elcoro, Luis; Perez-Mato, J. M.; Madariaga, Gotzon; García, Alberto
Revision of pyrrhotite structures within a common superspace model
Acta Crystallographica Section B, 2007, 63, 693-702
2102945 CIF
Paper
O3 Pb Ti0.35 Zr0.65R 3 c :H5.7779174; 5.7779174; 14.2692051
90; 90; 120
412.547Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.
X-ray powder difraction structural characterization of Pb(1-x)Ba(x)Zr(0.65)Ti(0.35)O3 ceramic.
Acta Crystallographica, Section B, 2007, 63, 713-718
2102946 CIF
Paper
O3 Pb Ti0.35 Zr0.65P m -3 m4.09836; 4.09836; 4.09836
90; 90; 90
68.8383Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.
X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic
Acta Crystallographica Section B, 2007, 63, 713-718
2102947 CIF
Paper
Ba0.1 O3 Pb0.9 Ti0.35 Zr0.65R 3 c :H5.78826; 5.78826; 14.27227
90; 90; 120
414.114Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.
X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic
Acta Crystallographica Section B, 2007, 63, 713-718
2102948 CIF
Paper
Ba0.1 O3 Pb0.9 Ti0.35 Zr0.65P m -3 m4.10755; 4.10755; 4.10755
90; 90; 90
69.3024Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.
X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic
Acta Crystallographica Section B, 2007, 63, 713-718
2102949 CIF
Paper
Ba0.2 O3 Pb0.8 Ti0.35 Zr0.65R 3 c :H5.79776; 5.79776; 14.26758
90; 90; 120
415.338Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.
X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic
Acta Crystallographica Section B, 2007, 63, 713-718
2102950 CIF
Paper
Ba0.2 O3 Pb0.8 Ti0.35 Zr0.65P m -3 m4.11161; 4.11161; 4.11161
90; 90; 90
69.5082Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.
X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic
Acta Crystallographica Section B, 2007, 63, 713-718
2102951 CIF
Paper
Ba0.3 O3 Pb0.7 Ti0.35 Zr0.65P m -3 m4.11241; 4.11241; 4.11241
90; 90; 90
69.5487Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.
X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic
Acta Crystallographica Section B, 2007, 63, 713-718
2102952 CIF
Paper
Ba0.4 O3 Pb0.6 Ti0.35 Zr0.65P m -3 m4.11604; 4.11604; 4.11604
90; 90; 90
69.7331Mir, M.; Mascarenhas, Y.P.; Mastelaro, V.R.; Neves, P.P.; Doriguetto, A.C.; Garcia, D.; Lente, M.H.; Eiras, J.A.
X-ray powder diffraction structural characterization of Pb~1{-~<i>x</i>}Ba~<i>x~</i>Zr~0.65~Ti~0.35~O~3~ ceramic
Acta Crystallographica Section B, 2007, 63, 713-718
2102953 CIF
HKL
Paper
B6 CeP m -3 m4.14586; 4.14586; 4.14586
90; 90; 90
71.26Ryoko, Makita; k̄iyoaki, Tanaka; Ōnuki, Yoshichika; H̄iroshi, Tatewaki
Inversion of 4<i>f</i>-states in CeB~6~ thermally excited at 430K
Acta Crystallographica Section B, 2007, 63, 683-692
2102954 CIF
HKL
Paper
C11 H21 N3 O5P 21 21 216.825; 9.042; 21.728
90; 90; 90
1340.9Kalinowski, Roman; Dittrich, Birger; Hübschle, Christian; Luger, Peter; Paulmann, Carsten
Experimental charge density of <small>L</small>-alanyl-<small>L</small>-prolyl-<small>L</small>-alanine hydrate: classical multipole and invariom approach, analysis of intra- and intermolecular topological properties
Acta Crystallographica Section B, 2007, 63, 753-767
2102955 CIF
Paper
Al14 Ca12 O33I -4 3 d11.9794; 11.9794; 11.9794
90; 90; 90
1719.12Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.
Structure and oxygen mobility in mayenite (Ca~12~Al~14~O~33~): a high-temperature neutron powder diffraction study
Acta Crystallographica Section B, 2007, 63, 675-682
2102956 CIF
Paper
Al14 Ca12 O33I -4 3 d12.0308; 12.0308; 12.0308
90; 90; 90
1741.34Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.
Structure and oxygen mobility in mayenite (Ca~12~Al~14~O~33~): a high-temperature neutron powder diffraction study
Acta Crystallographica Section B, 2007, 63, 675-682
2102957 CIF
Paper
Al14 Ca12 O33I -4 3 d12.0449; 12.0449; 12.0449
90; 90; 90
1747.47Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.
Structure and oxygen mobility in mayenite (Ca~12~Al~14~O~33~): a high-temperature neutron powder diffraction study
Acta Crystallographica Section B, 2007, 63, 675-682
2102958 CIF
Paper
Al14 Ca12 O33I -4 3 d12.0585; 12.0585; 12.0585
90; 90; 90
1753.4Boysen, H.; Lerch, M.; Stys, A.; Senyshyn, A.
Structure and oxygen mobility in mayenite (Ca~12~Al~14~O~33~): a high-temperature neutron powder diffraction study
Acta Crystallographica Section B, 2007, 63, 675-682
2102959 CIF
Paper
C2 H2 Cl2 O2P 1 21/n 14.914; 11.384; 8.418
90; 93.45; 90
470.1Roman Gajda; Andrzej Katrusiak
Compressed hydrogen-bond effects in the pressure-frozen chloroacetic acid
Acta Crystallographica Section B, 2007, 63, 896-902
2102960 CIF
HKL
Paper
C2 H2 Cl2 O2P 1 21/n 14.6404; 11.134; 8.299
90; 92.89; 90
428.2Roman Gajda; Andrzej Katrusiak
Compressed hydrogen-bond effects in the pressure-frozen chloroacetic acid
Acta Crystallographica Section B, 2007, 63, 896-902
2102961 CIF
Paper
C2 H2 Cl2 O2P 1 21/n 14.6589; 11.174; 8.2013
90; 92.88; 90
426.41Roman Gajda; Andrzej Katrusiak
Compressed hydrogen-bond effects in the pressure-frozen chloroacetic acid
Acta Crystallographica Section B, 2007, 63, 896-902
2102962 CIF
HKL
Paper
C2 H2 Cl2 O2P 1 21/n 14.563; 10.978; 8.087
90; 92.6; 90
404.7Roman Gajda; Andrzej Katrusiak
Compressed hydrogen-bond effects in the pressure-frozen chloroacetic acid
Acta Crystallographica Section B, 2007, 63, 896-902
2102963 CIF
Paper
C20 H12 N2 O2P 1 21/c 16.6661; 3.868; 27.386
90; 100.58; 90
694.13Buchsbaum, Christian; Schmidt, Martin U.
Rietveld refinement of a wrong crystal structure
Acta Crystallographica Section B, 2007, 63, 926-932
2102964 CIF
HKL
Paper
C H2 Br ClC 1 2/c 111.959; 4.4531; 14.873
90; 112.96; 90
729.3Podsiadło, Marcin; Katrusiak, Andrzej
Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl
Acta Crystallographica Section B, 2007, 63, 903-911
2102965 CIF
HKL
Paper
C H2 Br ClC 1 2/c 111.874; 4.4224; 14.582
90; 112.04; 90
709.8Podsiadło, Marcin; Katrusiak, Andrzej
Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl
Acta Crystallographica Section B, 2007, 63, 903-911
2102966 CIF
HKL
Paper
C H2 Br ClP b c n4.1126; 8.0685; 9.755
90; 90; 90
323.7Podsiadło, Marcin; Katrusiak, Andrzej
Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl
Acta Crystallographica Section B, 2007, 63, 903-911
2102967 CIF
HKL
Paper
C H2 Br ClP b c n3.9929; 7.9351; 9.6808
90; 90; 90
306.73Podsiadło, Marcin; Katrusiak, Andrzej
Isobaric and isochoric freezing of CH~2~BrCl and isostructural relations between CH~2~Cl~2~, CH~2~Br~2~ and CH~2~BrCl
Acta Crystallographica Section B, 2007, 63, 903-911
2102968 CIF
Paper
C24 H31 N O3P 21 21 216.7448; 11.849; 26.976
90; 90; 90
2155.9Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.
Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes
Acta Crystallographica Section B, 2007, 63, 933-940
2102969 CIF
HKL
Paper
C24 H31 N O3P 21 21 216.7891; 11.852; 26.822
90; 90; 90
2158.2Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.
Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes
Acta Crystallographica Section B, 2007, 63, 933-940
2102970 CIF
HKL
Paper
C24 H31 N O3P 21 21 216.832; 11.897; 26.609
90; 90; 90
2162.8Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.
Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes
Acta Crystallographica Section B, 2007, 63, 933-940
2102971 CIF
HKL
Paper
C24 H31 N O3P 21 21 216.8632; 11.9445; 26.305
90; 90; 90
2156.4Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.
Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes
Acta Crystallographica Section B, 2007, 63, 933-940
2102972 CIF
HKL
Paper
C24 H31 N O3P 21 21 216.8834; 12.0641; 25.924
90; 90; 90
2152.8Turowska-Tyrk, Ilona; Bakowicz, Julia; Scheffer, John R.
Monitoring structural transformations in crystals. 11. Yang photocyclizations ‒ one type of reaction, but diversity of structural changes
Acta Crystallographica Section B, 2007, 63, 933-940
2102973 CIF
Paper
C13 H11 N3 OP b c a7.1927; 21.2168; 28.6771
90; 90; 90
4376.3Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher
Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers
Acta Crystallographica Section B, 2007, 63, 879-895
2102974 CIF
Paper
C13 H10 F N3 OP -17.4815; 11.1344; 14.5365
90.663; 104.903; 109.268
1098.45Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher
Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers
Acta Crystallographica Section B, 2007, 63, 879-895
2102975 CIF
Paper
C13 H10 F N3 OP b c a13.191; 18.8057; 18.2843
90; 90; 90
4535.7Wardell, Solange M. S. V.; de Souza, Marcus V. N.; Wardell, James L.; Low, John N.; Glidewell, Christopher
Supramolecular structures in <i>N</i>-isonicotinoyl arylaldehydehydrazones: multiple hydrogen-bonding modes in series of geometric isomers
Acta Crystallographica Section B, 2007, 63, 879-895

Blue left arrow Blue left arrow First | Blue left arrow Previous 50 | of 8 | Next 50 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!