Crystallography Open Database

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Searching year of publication is 2009

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2104354 CIF
Paper
C20 H25 N O6P 21 21 217.553; 13.5745; 19.154
90; 90; 90
1963.8Rathore, R. S.; Reddy, B. Palakshi; Vijayakumar, V.; Ragavan, R. Venkat; Narasimhamurthy, T.
Hantzsch 1,4-dihydropyridine esters and analogs: candidates for generating reproducible one-dimensional packing motifs
Acta Crystallographica Section B, 2009, 65, 375-381
2104355 CIF
Paper
C20 H25 N O5P 1 21/n 19.7834; 7.4749; 26.6788
90; 98.171; 90
1931.2Rathore, R. S.; Reddy, B. Palakshi; Vijayakumar, V.; Ragavan, R. Venkat; Narasimhamurthy, T.
Hantzsch 1,4-dihydropyridine esters and analogs: candidates for generating reproducible one-dimensional packing motifs
Acta Crystallographica Section B, 2009, 65, 375-381
2104356 CIF
Paper
C17 H18 N2 O4P 1 21/n 18.842; 16.0785; 11.2188
90; 104.606; 90
1543.4Rathore, R. S.; Reddy, B. Palakshi; Vijayakumar, V.; Ragavan, R. Venkat; Narasimhamurthy, T.
Hantzsch 1,4-dihydropyridine esters and analogs: candidates for generating reproducible one-dimensional packing motifs
Acta Crystallographica Section B, 2009, 65, 375-381
2104357 CIF
Paper
Ba O11 V6P 63/m m c5.797; 5.797; 13.301
90; 90; 120
387.1Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej
Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~
Acta Crystallographica Section B, 2009, 65, 326-333
2104358 CIF
Paper
Ba O11 V6P 63/m m c5.785; 5.785; 13.266
90; 90; 120
384.5Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej
Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~
Acta Crystallographica Section B, 2009, 65, 326-333
2104359 CIF
Paper
Ba O11 V6P 63 m c5.775; 5.775; 13.238
90; 90; 120
382.3Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej
Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~
Acta Crystallographica Section B, 2009, 65, 326-333
2104360 CIF
Paper
Ba O11 V6P 63 m c5.763; 5.763; 13.206
90; 90; 120
379.8Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej
Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~
Acta Crystallographica Section B, 2009, 65, 326-333
2104361 CIF
Paper
Ba O11 V6P 63 m c5.754; 5.754; 13.182
90; 90; 120
378Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej
Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~
Acta Crystallographica Section B, 2009, 65, 326-333
2104362 CIF
Paper
Ba O11 V6P 63 m c5.746; 5.746; 13.16
90; 90; 120
376.3Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej
Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~
Acta Crystallographica Section B, 2009, 65, 326-333
2104363 CIF
Paper
Ba O11 V6P 63 m c5.739; 5.739; 13.144
90; 90; 120
374.9Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej
Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~
Acta Crystallographica Section B, 2009, 65, 326-333
2104364 CIF
HKL
Paper
C8 H9 N O2P 1 21/n 17.0915; 9.2149; 11.6015
90; 97.865; 90
751Bouhmaida, Nouzha; Bonhomme, François; Guillot, Benoît; Jelsch, Christian; Ghermani, Nour Eddine
Charge density and electrostatic potential analyses in paracetamol
Acta Crystallographica Section B, 2009, 65, 363-374
2104365 CIF
Paper
Cl Cu2 H3 O3P -19.1646; 9.2029; 9.2102
95.858; 96.29; 96.507
761.97Malcherek, Thomas; Schlüter, Jochen
Structures of the pseudo-trigonal polymorphs of Cu~2~(OH)~3~Cl
Acta Crystallographica Section B, 2009, 65, 334-341
2104366 CIF
HKL
Paper
Cl Cu2 H3 O3P 1 21/n 16.1226; 6.8346; 9.1841
90; 99.577; 90
378.96Malcherek, Thomas; Schlüter, Jochen
Structures of the pseudo-trigonal polymorphs of Cu~2~(OH)~3~Cl
Acta Crystallographica Section B, 2009, 65, 334-341
2104367 CIF
HKL
Paper
C4 H12 Ca O10P -16.241; 8.214; 10.411
94.92; 106; 107.55
480.8Le Bail, A.; Bazin, D.; Daudon, M.; Brochot, A.; Robbez-Masson, V.; Maisonneuve, V.
Racemic calcium tartrate tetrahydrate [form (II)] in rat urinary stones
Acta Crystallographica Section B, 2009, 65, 350-354
2104368 CIF
HKL
Paper
C18 H24 N5 O2 P3 S2P 4111.4912; 11.4912; 16.789
90; 90; 90
2216.95Coles, Simon; Davies, David; Hursthouse, Michael; Yeşilot, Serkan; Çoşut, Bünyemin; Kılıç, Adem
Absolute structure determination as a reference for the enantiomeric resolution of racemic mixtures of cyclophosphazenes <i>via</i> chiral high-performance liquid chromatography
Acta Crystallographica Section B, 2009, 65, 355-362
2104369 CIF
HKL
Paper
C18 H24 N5 O2 P3 S2P 4311.4899; 11.4899; 16.7827
90; 90; 90
2215.62Coles, Simon; Davies, David; Hursthouse, Michael; Yeşilot, Serkan; Çoşut, Bünyemin; Kılıç, Adem
Absolute structure determination as a reference for the enantiomeric resolution of racemic mixtures of cyclophosphazenes <i>via</i> chiral high-performance liquid chromatography
Acta Crystallographica Section B, 2009, 65, 355-362
2104370 CIF
HKL
Paper
C18 H24 N5 O4 P3P b c n38.7541; 10.1505; 10.555
90; 90; 90
4152.1Coles, Simon; Davies, David; Hursthouse, Michael; Yeşilot, Serkan; Çoşut, Bünyemin; Kılıç, Adem
Absolute structure determination as a reference for the enantiomeric resolution of racemic mixtures of cyclophosphazenes <i>via</i> chiral high-performance liquid chromatography
Acta Crystallographica Section B, 2009, 65, 355-362
2104371 CIF
HKL
Paper
C18 H24 N5 O4 P3P 3210.492; 10.492; 16.6645
90; 90; 120
1588.69Coles, Simon; Davies, David; Hursthouse, Michael; Yeşilot, Serkan; Çoşut, Bünyemin; Kılıç, Adem
Absolute structure determination as a reference for the enantiomeric resolution of racemic mixtures of cyclophosphazenes <i>via</i> chiral high-performance liquid chromatography
Acta Crystallographica Section B, 2009, 65, 355-362
2104372 CIF
Paper
C18 H24 N5 O4 P3P 1 21 16.3073; 17.6438; 9.5481
90; 96.552; 90
1055.62Coles, Simon; Davies, David; Hursthouse, Michael; Yeşilot, Serkan; Çoşut, Bünyemin; Kılıç, Adem
Absolute structure determination as a reference for the enantiomeric resolution of racemic mixtures of cyclophosphazenes <i>via</i> chiral high-performance liquid chromatography
Acta Crystallographica Section B, 2009, 65, 355-362
2104373 CIF
HKL
Paper
Al282.23 Ta161.77F -4 3 m19.1663; 19.1663; 19.1663
90; 90; 90
7040.68Weber, Thomas; Dshemuchadse, Julia; Kobas, Miroslav; Conrad, Matthias; Harbrecht, Bernd; Steurer, Walter
Large, larger, largest ‒ a family of cluster-based tantalum copper aluminides with giant unit cells. I. Structure solution and refinement
Acta Crystallographica Section B, 2009, 65, 308-317
2104374 CIF
HKL
Paper
Al3339.8 Cu231.95 Ta2336F -4 3 m45.376; 45.376; 45.376
90; 90; 90
93428Weber, Thomas; Dshemuchadse, Julia; Kobas, Miroslav; Conrad, Matthias; Harbrecht, Bernd; Steurer, Walter
Large, larger, largest ‒ a family of cluster-based tantalum copper aluminides with giant unit cells. I. Structure solution and refinement
Acta Crystallographica Section B, 2009, 65, 308-317
2104375 CIF
HKL
Paper
Al12827.56 Cu1244.05 Ta9063F -4 3 m71.49; 71.49; 71.49
90; 90; 90
365373Weber, Thomas; Dshemuchadse, Julia; Kobas, Miroslav; Conrad, Matthias; Harbrecht, Bernd; Steurer, Walter
Large, larger, largest ‒ a family of cluster-based tantalum copper aluminides with giant unit cells. I. Structure solution and refinement
Acta Crystallographica Section B, 2009, 65, 308-317
2104376 CIF
Paper
K0.05 Na0.95 Nb O3R 3 c :H5.51848; 5.51848; 13.78476
90; 90; 120
363.554Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104377 CIF
Paper
K0.05 Na0.95 Nb O3R 3 c :H5.51972; 5.51972; 13.7835
90; 90; 120
363.684Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104378 CIF
Paper
K0.05 Na0.95 Nb O3R 3 c :H5.52229; 5.52229; 13.78243
90; 90; 120
363.995Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104379 CIF
Paper
K0.05 Na0.95 Nb O3R 3 c :H5.52539; 5.52539; 13.78058
90; 90; 120
364.354Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104380 CIF
Paper
K0.05 Na0.95 Nb O3R 3 c :H5.52922; 5.52922; 13.77931
90; 90; 120
364.826Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104381 CIF
Paper
K0.3 Na0.7 Nb O3R 3 c :H5.59214; 5.59214; 13.843
90; 90; 120
374.901Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104382 CIF
Paper
K0.3 Na0.7 Nb O3R 3 c :H5.59326; 5.59326; 13.8432
90; 90; 120
375.057Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104383 CIF
Paper
K0.3 Na0.7 Nb O3R 3 c :H5.59447; 5.59447; 13.8429
90; 90; 120
375.211Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104384 CIF
Paper
K0.3 Na0.7 Nb O3R 3 c :H5.59575; 5.59575; 13.8429
90; 90; 120
375.383Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104385 CIF
Paper
K0.3 Na0.7 Nb O3R 3 c :H5.59717; 5.59717; 13.8423
90; 90; 120
375.557Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104386 CIF
Paper
K0.05 Na0.95 Nb O3P 1 m 15.60123; 7.79834; 5.548
90; 90.051; 90
242.338Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104387 CIF
Paper
K0.05 Na0.95 Nb O3R 3 c :H5.5298; 5.5298; 13.7692
90; 90; 120
364.63Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104388 CIF
Paper
K0.3 Na0.7 Nb O3P 1 m 15.65868; 3.93856; 5.6248
90; 90.073; 90
125.36Zhang, N.; Glazer, A. M.; Baker, D.; Thomas, P. A.
Structures of K~0.05~Na~0.95~NbO~3~ (50‒300K) and K~0.30~Na~0.70~NbO~3~ (100‒200K)
Acta Crystallographica Section B, 2009, 65, 291-299
2104389 CIF
Paper
Bi O6 Pb2 VP 1 21/m 115.0501; 5.9011; 7.5322
90; 101.566; 90
655.37Roussel, Pascal; Labidi, Olfa; Huve, Marielle; Drache, Michel; Wignacourt, Jean-Pierre; Petricek, Vaclav
The incommensurately modulated crystal structure of β-Pb~2~BiVO~6~: interpretation of the phase transition α →β \ρightarrow δ and conduction properties of related materials
Acta Crystallographica Section B, 2009, 65, 416-425
2104390 CIF
Paper
C90 H150 N24 O24 P6P -113.1528; 13.7179; 16.5876
87.8019; 70.8182; 83.8446
2810.41Gholivand, Khodayar; Mostaanzadeh, Hossein; Koval, Tomas; Dusek, Michal; Erben, Mauricio F.; Della Védova, Carlos O.
Synthesis, crystal structure and spectroscopic properties of a novel carbacylamidophosphate: <i>N</i>-(3-nitrobenzoyl)-<i>N</i>',<i>N</i>''-bis(<i>tert</i>-butyl)phosphoric triamide
Acta Crystallographica Section B, 2009, 65, 502-508
2104391 CIF
HKL
Paper
B Be2 F2 O3 TlR 3 2 :H4.4387; 4.4387; 19.942
90; 90; 120
340.26McMillen, Colin D.; Hu, Jia; VanDerveer, Donald; Kolis, Joseph W.
Trigonal structures of <i>A</i>Be~2~BO~3~F~2~ (<i>A</i> = Rb, Cs, Tl) crystals
Acta Crystallographica Section B, 2009, 65, 445-449
2104392 CIF
HKL
Paper
B Be2 F2 O3 RbR 3 2 :H4.4387; 4.4387; 19.82
90; 90; 120
338.18McMillen, Colin D.; Hu, Jia; VanDerveer, Donald; Kolis, Joseph W.
Trigonal structures of <i>A</i>Be~2~BO~3~F~2~ (<i>A</i> = Rb, Cs, Tl) crystals
Acta Crystallographica Section B, 2009, 65, 445-449
2104393 CIF
HKL
Paper
B Be2 Cs F2 O3R 3 2 :H4.4575; 4.4575; 21.31
90; 90; 120
366.69McMillen, Colin D.; Hu, Jia; VanDerveer, Donald; Kolis, Joseph W.
Trigonal structures of <i>A</i>Be~2~BO~3~F~2~ (<i>A</i> = Rb, Cs, Tl) crystals
Acta Crystallographica Section B, 2009, 65, 445-449
2104394 CIF
Paper
Cs2 Mg O12 Si5P b c a13.6371; 13.6689; 13.728
90; 90; 90
2558.96Bell, A. M. T.; Henderson, C. M. B.
Crystal structures and cation ordering in Cs~2~MgSi~5~O~12~, Rb~2~MgSi~5~O~12~ and Cs~2~ZnSi~5~O~12~ leucites
Acta Crystallographica Section B, 2009, 65, 435-444
2104395 CIF
Paper
Mg O12 Rb2 Si5P b c a13.422; 13.406; 13.73
90; 90; 90
2470.5Bell, A. M. T.; Henderson, C. M. B.
Crystal structures and cation ordering in Cs~2~MgSi~5~O~12~, Rb~2~MgSi~5~O~12~ and Cs~2~ZnSi~5~O~12~ leucites
Acta Crystallographica Section B, 2009, 65, 435-444
2104396 CIF
Paper
Cs2 O12 Si5 ZnP b c a13.6415; 13.6233; 13.6653
90; 90; 90
2539.6Bell, A. M. T.; Henderson, C. M. B.
Crystal structures and cation ordering in Cs~2~MgSi~5~O~12~, Rb~2~MgSi~5~O~12~ and Cs~2~ZnSi~5~O~12~ leucites
Acta Crystallographica Section B, 2009, 65, 435-444
2104397 CIF
Paper
C24 H18 Cl4 F6 Fe N4 O2 PP 1 21/a 18.425; 35.973; 9.0586
90; 91.942; 90
2743.84Collet, Eric; Boillot, Marie-Laure; Hebert, Johan; Moisan, Nicolas; Servol, Marina; Lorenc, Maciej; Toupet, Loïc; Buron-Le Cointe, Marylise; Tissot, Antoine; Sainton, Joelle
Polymorphism in the spin-crossover ferric complexes [(TPA)Fe^III^(TCC)]PF~6~
Acta Crystallographica Section B, 2009, 65, 474-480
2104398 CIF
Paper
C24 H18 Cl4 F6 Fe N4 O2 PP n a 218.3086; 36.1529; 9.1975
90; 90; 90
2762.74Collet, Eric; Boillot, Marie-Laure; Hebert, Johan; Moisan, Nicolas; Servol, Marina; Lorenc, Maciej; Toupet, Loïc; Buron-Le Cointe, Marylise; Tissot, Antoine; Sainton, Joelle
Polymorphism in the spin-crossover ferric complexes [(TPA)Fe^III^(TCC)]PF~6~
Acta Crystallographica Section B, 2009, 65, 474-480
2104399 CIF
Paper
C24 H18 Cl4 F6 Fe N4 O2 PP 1 21/a 18.6788; 37.001; 9.2881
90; 91.255; 90
2981.9Collet, Eric; Boillot, Marie-Laure; Hebert, Johan; Moisan, Nicolas; Servol, Marina; Lorenc, Maciej; Toupet, Loïc; Buron-Le Cointe, Marylise; Tissot, Antoine; Sainton, Joelle
Polymorphism in the spin-crossover ferric complexes [(TPA)Fe^III^(TCC)]PF~6~
Acta Crystallographica Section B, 2009, 65, 474-480
2104400 CIF
Paper
C24 H18 Cl4 F6 Fe N4 O2 PP n a 218.561; 37.414; 9.452
90; 90; 90
3027.5Collet, Eric; Boillot, Marie-Laure; Hebert, Johan; Moisan, Nicolas; Servol, Marina; Lorenc, Maciej; Toupet, Loïc; Buron-Le Cointe, Marylise; Tissot, Antoine; Sainton, Joelle
Polymorphism in the spin-crossover ferric complexes [(TPA)Fe^III^(TCC)]PF~6~
Acta Crystallographica Section B, 2009, 65, 474-480
2104401 CIF
Paper
C9 H11 N O2P 1 1 218.1883; 10.6394; 20.4761
90; 90; 99.37
1760.05Chan, Eric J.; Rae, A. David; Welberry, T. Richard
On the polymorphism of benzocaine; a low-temperature structural phase transition for form (II)
Acta Crystallographica Section B, 2009, 65, 509-515
2104402 CIF
HKL
Paper
C9 H11 N O2P 1 21/c 18.257; 5.5009; 19.956
90; 91.699; 90
906.02Chan, Eric J.; Rae, A. David; Welberry, T. Richard
On the polymorphism of benzocaine; a low-temperature structural phase transition for form (II)
Acta Crystallographica Section B, 2009, 65, 509-515
2104403 CIF
HKL
Paper
C9 H11 N O2P 21 21 218.2424; 5.3111; 20.9044
90; 90; 90
915.12Chan, Eric J.; Rae, A. David; Welberry, T. Richard
On the polymorphism of benzocaine; a low-temperature structural phase transition for form (II)
Acta Crystallographica Section B, 2009, 65, 509-515

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