Crystallography Open Database
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Searching journal of publication like 'Acta crystallographica Section B, Structural science, crystal engineering and materials'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 2102646 | CIF HKL Paper | C58 H62 N10 O8 P6 | P -1 | 10.735; 11.067; 14.259 75.65; 83.84; 61.096 | 1436.6 | Coles, Simon J; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Yenilmez Çiftçi, Gonul Structural investigations of phosphorus–nitrogen compounds. 6. Relationships between molecular parameters in per-<i>X</i>-substituted bridged spermine derivatives and basicity constants Σα<i>R</i> of substituents Acta Crystallographica Section B, 2004, 60, 739-747 |
| 2102647 | CIF HKL Paper | C22 H46 N10 O8 P6 | P 1 21/c 1 | 9.871; 29.741; 11.838 90; 106.18; 90 | 3337.7 | Coles, Simon J; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Yenilmez Çiftçi, Gonul Structural investigations of phosphorus–nitrogen compounds. 6. Relationships between molecular parameters in per-<i>X</i>-substituted bridged spermine derivatives and basicity constants Σα<i>R</i> of substituents Acta Crystallographica Section B, 2004, 60, 739-747 |
| 2102648 | CIF HKL Paper | C64 H68 N10 P6 | C 1 2/c 1 | 11.0388; 30.2194; 17.8858 90; 93.002; 90 | 5958.3 | Coles, Simon J; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Yenilmez Çiftçi, Gonul Structural investigations of phosphorus–nitrogen compounds. 6. Relationships between molecular parameters in per-<i>X</i>-substituted bridged spermine derivatives and basicity constants Σα<i>R</i> of substituents Acta Crystallographica Section B, 2004, 60, 739-747 |
| 2102649 | CIF Paper | C58 H70 N18 O P6 | P -1 | 13.112; 15.16; 17.546 81.67; 74.73; 67.08 | 3095.5 | Coles, Simon J; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Yenilmez Çiftçi, Gonul Structural investigations of phosphorus‒nitrogen compounds. 6. Relationships between molecular parameters in per-<i>X</i>-substituted bridged spermine derivatives and basicity constants Σα<i>R</i> of substituents Acta Crystallographica Section B, 2004, 60, 739-747 |
| 2102650 | CIF HKL Paper | C42 H54 N18 P6 | P 1 21/c 1 | 30.586; 9.66; 18.449 90; 94.599; 90 | 5433 | Coles, Simon J; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Yenilmez Çiftçi, Gonul Structural investigations of phosphorus‒nitrogen compounds. 6. Relationships between molecular parameters in per-<i>X</i>-substituted bridged spermine derivatives and basicity constants Σα<i>R</i> of substituents Acta Crystallographica Section B, 2004, 60, 739-747 |
| 2102651 | CIF Paper | C42 H102 N18 P6 | P -1 | 13.476; 14.437; 16.34 111.28; 96.87; 93.69 | 2921 | Coles, Simon J; Davies, David B.; Hursthouse, Michael B.; Kiliç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Yenilmez Çiftçi, Gonul Structural investigations of phosphorus–nitrogen compounds. 6. Relationships between molecular parameters in per-<i>X</i>-substituted bridged spermine derivatives and basicity constants Σα<i>R</i> of substituents Acta Crystallographica Section B, 2004, 60, 739-747 |
| 2102652 | CIF Paper | Cr F3 | R -3 c :H | 4.9863; 4.9863; 13.2142 90; 90; 120 | 284.53 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2102653 | CIF Paper | Cr F3 | R -3 c :H | 4.9106; 4.9106; 13.2286 90; 90; 120 | 276.26 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2102654 | CIF Paper | Cr F3 | R -3 c :H | 4.8593; 4.8593; 13.2329 90; 90; 120 | 270.6 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2102655 | CIF Paper | Cr F3 | R -3 c :H | 4.786; 4.786; 13.237 90; 90; 120 | 262.58 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2102656 | CIF Paper | Cr F3 | R -3 c :H | 4.7189; 4.7189; 13.219 90; 90; 120 | 254.92 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2102657 | CIF Paper | Cr F3 | R -3 c :H | 4.6639; 4.6639; 13.192 90; 90; 120 | 248.51 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2102658 | CIF Paper | Cr F3 | R -3 c :H | 4.6382; 4.6382; 13.172 90; 90; 120 | 245.4 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2102659 | CIF Paper | Cr F3 | R -3 c :H | 4.6265; 4.6265; 13.163 90; 90; 120 | 244 | Jοrgensen, J.-E.; Marshall, W.G.; Smith, R.I. The compression mechanism of CrF~3~ Acta Crystallographica Section B, 2004, 60, 669-673 |
| 2102660 | CIF Paper | C8 H15 N O2 | P b c a | 8.248; 19.679; 10.581 90; 90; 90 | 1717.4 | Kálmán, Alajos; Fábián, László; Argay, Gyula; Bernáth, Gábor; Cs. Gyarmati, Zsuzsanna Different forms of antiparallel stacking of hydrogen-bonded antidromic rings in the solid state: polymorphism with virtually the same unit cell and two-dimensional isostructurality with alternating layers Acta Crystallographica Section B, 2004, 60, 755-762 |
| 2102661 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.1008; 3.0113; 10.41 90; 92.258; 90 | 379.04 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102662 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0848; 3.0101; 10.4014 90; 92.187; 90 | 378.09 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102663 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0828; 3.0099; 10.4045 90; 92.192; 90 | 378.11 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102664 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.1008; 3.0113; 10.41 90; 92.258; 90 | 379.04 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102665 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.1008; 3.0113; 10.41 90; 92.258; 90 | 379.04 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102666 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0848; 3.0101; 10.4014 90; 92.187; 90 | 378.09 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102667 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0848; 3.0101; 10.4014 90; 92.187; 90 | 378.09 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102668 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0828; 3.0099; 10.4045 90; 92.192; 90 | 378.11 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102669 | CIF Paper | Ga4.8 Na0.8 O10 Ti1.2 | C 1 2/m 1 | 12.0828; 3.0099; 10.4045 90; 92.192; 90 | 378.11 | Michiue, Yuichi; Sato, Akira Structure Refinements of Na~0.8~Ti~1.2~Ga~4.8~O~10~ at Low Temperatures: X-Ray Diffraction Analysis for Sodium Ion Distribution in a One-Dimensional Tunnel-like Space Acta Crystallographica, Section B, 2004, 60, 692-697 |
| 2102670 | CIF Paper | C4 H2 B Li O9 | P b c a | 16.075; 15.88; 5.6008 90; 90; 90 | 1429.7 | Zavalij, Peter Y.; Yang, Shoufeng; Whittingham, M. Stanley Structural chemistry of new lithium bis(oxalato)borate solvates Acta Crystallographica Section B, 2004, 60, 716-724 |
| 2102671 | CIF Paper | C18 H15 B2 Li2 N5 O16 | P 1 21/n 1 | 7.6346; 22.631; 14.9338 90; 91.879; 90 | 2578.9 | Zavalij, Peter Y.; Yang, Shoufeng; Whittingham, M. Stanley Structural chemistry of new lithium bis(oxalato)borate solvates Acta Crystallographica Section B, 2004, 60, 716-724 |
| 2102672 | CIF Paper | C8 H8 B Li O9.33 | C 1 2/m 1 | 16.3987; 7.6308; 10.9904 90; 121.201; 90 | 1176.4 | Zavalij, Peter Y.; Yang, Shoufeng; Whittingham, M. Stanley Structural chemistry of new lithium bis(oxalato)borate solvates Acta Crystallographica Section B, 2004, 60, 716-724 |
| 2102673 | CIF Paper | C8 H10 B Li O10 | P -1 | 8.669; 8.8519; 9.3328 114.159; 94.764; 106.412 | 610.46 | Zavalij, Peter Y.; Yang, Shoufeng; Whittingham, M. Stanley Structural chemistry of new lithium bis(oxalato)borate solvates Acta Crystallographica Section B, 2004, 60, 716-724 |
| 2102674 | CIF Paper | C17 H20 B2 Li2 O23 | P -1 | 9.1327; 9.6378; 14.812 80.64; 79.414; 70.642 | 1201.8 | Zavalij, Peter Y.; Yang, Shoufeng; Whittingham, M. Stanley Structural chemistry of new lithium bis(oxalato)borate solvates Acta Crystallographica Section B, 2004, 60, 716-724 |
| 2102675 | CIF Paper | C16 H16 B Li O20 | I -4 | 10.2343; 10.2343; 10.8245 90; 90; 90 | 1133.77 | Zavalij, Peter Y.; Yang, Shoufeng; Whittingham, M. Stanley Structural chemistry of new lithium bis(oxalato)borate solvates Acta Crystallographica Section B, 2004, 60, 716-724 |
| 2102676 | CIF Paper | C5 H10 O2 | P 1 21/c 1 | 4.9347; 9.4163; 11.321 90; 97.39; 90 | 521.68 | Roman Gajda; Andrzej Katrusiak <i>In-situ</i> high-pressure study of the ordered phase of ethyl propionate Acta Crystallographica Section B, 2007, 63, 111-117 |
| 2102677 | CIF Paper | C5 H10 O2 | P 1 21/c 1 | 4.8917; 9.3649; 11.318 90; 97.24; 90 | 514.35 | Roman Gajda; Andrzej Katrusiak <i>In-situ</i> high-pressure study of the ordered phase of ethyl propionate Acta Crystallographica Section B, 2007, 63, 111-117 |
| 2102678 | CIF Paper | C5 H10 O2 | P 1 21/c 1 | 4.8455; 9.3249; 11.251 90; 97.52; 90 | 503.99 | Roman Gajda; Andrzej Katrusiak <i>In-situ</i> high-pressure study of the ordered phase of ethyl propionate Acta Crystallographica Section B, 2007, 63, 111-117 |
| 2102679 | CIF Paper | B Ca H O5 Si | P 1 21/a 1 | 9.646; 7.62; 4.839 90; 90.14; 90 | 355.7 | Ivanov, Yury; Belokoneva, Elena Multipole refinement and electron density analysis in natural borosilicate datolite using X-ray diffraction data Acta Crystallographica Section B, 2007, 63, 49-55 |
| 2102680 | CIF HKL Paper | C18 H36 Cl Li N2 O10 | P 21 21 21 | 10.0273; 13.3313; 16.8827 90; 90; 90 | 2256.8 | Guzei, Ilia A.; Lara C. Spencer Low-temperature enantiotropic <i>k</i>2 phase transition in the ionic 222-cryptand complex with LiClO~4~ Acta Crystallographica Section B, 2007, 63, 93-100 |
| 2102681 | CIF HKL Paper | C18 H36 Cl Li N2 O10 | P 21 21 21 | 10.0791; 13.3799; 17.0272 90; 90; 90 | 2296.24 | Guzei, Ilia A.; Lara C. Spencer Low-temperature enantiotropic <i>k</i>2 phase transition in the ionic 222-cryptand complex with LiClO~4~ Acta Crystallographica Section B, 2007, 63, 93-100 |
| 2102682 | CIF Paper | C4 H7 N3 O2 | P -1 | 15.829; 12.381; 12.391 90; 74.3; 83.1 | 2319.5 | Podsiadło, Marcin; Dziubek, Kamil F.; Katrusiak, Andrzej Pitfalls of data mining: triclinic polymorph of 2,2-aziridinedicarboxamide revisited Acta Crystallographica, Section B: Structural Science, 2007, 63, 118-123 |
| 2102683 | CIF Paper | C22 H30 N6 Ni S2 | P 41 21 2 | 10.2852; 10.2852; 22.2862 90; 90; 90 | 2357.55 | Nielsen, Kim T.; Harris, Pernille; Bechgaard, Klaus; Krebs, Frederik C. Structural study of four complexes of the <i>M</i>-N~2~S~2~ type derived from diethylphenylazothioformamide and the metals palladium, platinum, copper and nickel Acta Crystallographica Section B, 2007, 63, 151-156 |
| 2102684 | CIF Paper | C22 H30 Cu N6 S2 | P 41 21 2 | 10.2643; 10.2643; 22.3519 90; 90; 90 | 2354.9 | Nielsen, Kim T.; Harris, Pernille; Bechgaard, Klaus; Krebs, Frederik C. Structural study of four complexes of the <i>M</i>-N~2~S~2~ type derived from diethylphenylazothioformamide and the metals palladium, platinum, copper and nickel Acta Crystallographica Section B, 2007, 63, 151-156 |
| 2102685 | CIF Paper | C22 H30 N6 Pd S2 | C 1 2/c 1 | 16.036; 12.4564; 12.3311 90; 100.952; 90 | 2418.3 | Nielsen, Kim T.; Harris, Pernille; Bechgaard, Klaus; Krebs, Frederik C. Structural study of four complexes of the <i>M</i>-N~2~S~2~ type derived from diethylphenylazothioformamide and the metals palladium, platinum, copper and nickel Acta Crystallographica Section B, 2007, 63, 151-156 |
| 2102686 | CIF Paper | C22 H30 N6 Pt S2 | C 1 2/c 1 | 15.9317; 12.53; 12.3798 90; 100.755; 90 | 2427.9 | Nielsen, Kim T.; Harris, Pernille; Bechgaard, Klaus; Krebs, Frederik C. Structural study of four complexes of the <i>M</i>-N~2~S~2~ type derived from diethylphenylazothioformamide and the metals palladium, platinum, copper and nickel Acta Crystallographica Section B, 2007, 63, 151-156 |
| 2102687 | CIF Paper | Cu Na1.57664 O2 | C2/m(0\b0)s0 | 8.24153; 2.78589; 5.71687 90; 111.97; 90 | 121.727 | van Smaalen, Sander; Dinnebier, Robert; Sofin, Mikhail; Jansen,Martin Structures of incommensurate and commensurate composite crystals Na~<i>x~</i>CuO~2~ (<i>x</i> = 1.58, 1.6, 1.62) Acta Crystallographica Section B, 2007, 63, 17-25 |
| 2102688 | CIF Paper | Cu5 Na8 O10 | C2/m(0\b0)s0 | 8.2417; 2.7859; 5.7167 90; 111.971; 90 | 121.726 | van Smaalen, Sander; Dinnebier, Robert; Sofin, Mikhail; Jansen,Martin Structures of incommensurate and commensurate composite crystals Na~<i>x~</i>CuO~2~ (<i>x</i> = 1.58, 1.6, 1.62) Acta Crystallographica Section B, 2007, 63, 17-25 |
| 2102689 | CIF Paper | Cu Na1.61689 O2 | C2/m(0\b0)s0 | 8.23682; 2.79269; 5.71224 90; 111.67; 90 | 122.112 | van Smaalen, Sander; Dinnebier, Robert; Sofin, Mikhail; Jansen,Martin Structures of incommensurate and commensurate composite crystals Na~<i>x~</i>CuO~2~ (<i>x</i> = 1.58, 1.6, 1.62) Acta Crystallographica Section B, 2007, 63, 17-25 |
| 2102690 | CIF HKL Paper | C12 H24 Co I11 S6 | C 1 2/c 1 | 15.156; 17.772; 13.106 90; 96.67; 90 | 3506.2 | Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin Extended structures of polyiodide salts of transition metal macrocyclic complexes Acta Crystallographica Section B, 2007, 63, 81-92 |
| 2102691 | CIF HKL Paper | C12 H24 I6 Ni S6 | P 1 21/c 1 | 9.445; 9.042; 16.449 90; 97.83; 90 | 1391.7 | Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin Extended structures of polyiodide salts of transition metal macrocyclic complexes Acta Crystallographica Section B, 2007, 63, 81-92 |
| 2102692 | CIF HKL Paper | C12 H24 I10 Ni S6 | P b c a | 12.317; 15.602; 18.302 90; 90; 90 | 3517 | Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin Extended structures of polyiodide salts of transition metal macrocyclic complexes Acta Crystallographica Section B, 2007, 63, 81-92 |
| 2102693 | CIF HKL Paper | C8 H16 I6 Pd S4 | C 1 2/c 1 | 18.062; 23.602; 11.166 90; 109.81; 90 | 4478 | Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin Extended structures of polyiodide salts of transition metal macrocyclic complexes Acta Crystallographica Section B, 2007, 63, 81-92 |
| 2102694 | CIF HKL Paper | C12 H23 I10 N Pd S4 | P -1 | 9.336; 11.504; 16.431 85.49; 81.2; 86.93 | 1737 | Blake, Alexander J.; Li, Wan-Sheung; Lippolis, Vito; Parsons, Simon; Schröder, Martin Extended structures of polyiodide salts of transition metal macrocyclic complexes Acta Crystallographica Section B, 2007, 63, 81-92 |
| 2102695 | CIF HKL Paper | C4 H10 N2 | P 1 21/n 1 | 6.0817; 5.2501; 8.4646 90; 108.207; 90 | 256.74 | Loehlin, James H.; Okasako, Elizabeth L. N. Analysis of structures with saturated hydrogen bonding Acta Crystallographica Section B, 2007, 63, 132-141 |
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