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 |
|---|---|---|---|---|---|---|
| 2101479 | CIF Paper | C7 H3 Cl N2 O2 | P b c a | 9.469; 14.752; 10.859 90; 90; 90 | 1516.9 | Britton, D.; Cramer, C. J. Structures of four <i>o</i>-nitrobenzonitriles Acta Crystallographica Section B, 1996, 52, 344-351 |
| 2101480 | CIF Paper | C8 H6 N2 O2 | P b c a | 9.969; 14.728; 10.179 90; 90; 90 | 1494.5 | Britton, D.; Cramer, C. J. Structures of four <i>o</i>-nitrobenzonitriles Acta Crystallographica Section B, 1996, 52, 344-351 |
| 2101481 | CIF Paper | C7 H3 Cl N2 O2 | P 1 21/n 1 | 7.889; 15.064; 7.311 90; 118.22; 90 | 765.6 | Britton, D.; Cramer, C. J. Structures of four <i>o</i>-nitrobenzonitriles Acta Crystallographica Section B, 1996, 52, 344-351 |
| 2101482 | CIF Paper | C7 H3 N3 O4 | P b c n | 13.081; 9.027; 6.545 90; 90; 90 | 772.8 | Britton, D.; Cramer, C. J. Structures of four <i>o</i>-nitrobenzonitriles Acta Crystallographica Section B, 1996, 52, 344-351 |
| 2101483 | CIF Paper | C18 H8 N4 Se4 | P 1 21/c 1 | 12.5048; 3.8724; 18.5041 90; 104.131; 90 | 868.92 | Corfield, P. W. R.; La Placa, S. J. Structure of the charge-transfer salt 2,2',5,5'-tetraselenafulvalene‒7,7,8,8-tetracyano-<i>p</i>-quinodimethane (TSeF‒TCNQ) Acta Crystallographica Section B, 1996, 52, 384-387 |
| 2101484 | CIF Paper | Ca3 Fe2 O12 Si3 | I a -3 d | 12.0643; 12.0643; 12.0643 90; 90; 90 | 1756 | Pilati, T.; Demartin, F.; Gramaccioli, C. M. Atomic displacement parameters for garnets: a lattice-dynamical evaluation Acta Crystallographica Section B, 1996, 52, 239-250 |
| 2101485 | CIF Paper | C52 H49 F6 P5 Pt2 S | P 1 2/n 1 | 13.742; 11.058; 16.7504 90; 96.644; 90 | 2528.3 | Clegg, William; Capdevila, Mercè; González-Duarte, Pilar; Sola, Joan Structural investigation of homonuclear Pt~2~ and heteronuclear PdPt complexes containing a metal‒metal bond bridged by hydrido and sulfido ligands Acta Crystallographica Section B, 1996, 52, 270-276 |
| 2101486 | CIF Paper | C52 H49 F6 P5 Pd Pt S | P 1 2/n 1 | 13.724; 11.097; 16.74 90; 96.77; 90 | 2531.6 | Clegg, William; Capdevila, Mercè; González-Duarte, Pilar; Sola, Joan Structural investigation of homonuclear Pt~2~ and heteronuclear PdPt complexes containing a metal‒metal bond bridged by hydrido and sulfido ligands Acta Crystallographica Section B, 1996, 52, 270-276 |
| 2101487 | CIF Paper | C52 H49 F6 P5 Pt2 S | P 1 21/n 1 | 13.689; 21.857; 16.662 90; 95.92; 90 | 4959 | Clegg, William; Capdevila, Mercè; González-Duarte, Pilar; Sola, Joan Structural investigation of homonuclear Pt~2~ and heteronuclear PdPt complexes containing a metal‒metal bond bridged by hydrido and sulfido ligands Acta Crystallographica Section B, 1996, 52, 270-276 |
| 2101488 | CIF Paper | C6 H8 N6 O8 | P 1 21/c 1 | 11.559; 8.018; 11.697 90; 98.01; 90 | 1073.5 | Ammon, H. L.; Du, Z.; Gilardi, R. D.; Dave, P. R.; Forohar, F.; Axenrod, T. Structure of 1,3,5,7-tetranitro-3,7-diazabicyclo-[3.3.0]octane. Structure solution from molecular packing analysis Acta Crystallographica Section B, 1996, 52, 352-356 |
| 2101489 | CIF Paper | C6 H24 Cl9 N3 Sb2 | P 1 c 1 | 9.47; 9.034; 14.08 90; 95.81; 90 | 1198.4 | Zaleski, J.; Pietraszko, A. Structure at 200 and 298 K and X-ray investigations of the phase transition at 242 K of [NH~2~(CH~3~)~2~]~3~Sb~2~Cl~9~ (DMACA) Acta Crystallographica Section B, 1996, 52, 287-295 |
| 2101490 | CIF Paper | C6 H24 Cl9 N3 Sb2 | P 1 21/c 1 | 9.686; 9.037; 14.066 90; 95.57; 90 | 1225.4 | Zaleski, J.; Pietraszko, A. Structure at 200 and 298 K and X-ray investigations of the phase transition at 242 K of [NH~2~(CH~3~)~2~]~3~Sb~2~Cl~9~ (DMACA) Acta Crystallographica Section B, 1996, 52, 287-295 |
| 2101491 | CIF Paper | C16 H22 N4 O6 | P -1 | 8.534; 9.352; 12.371 92.59; 96.16; 116.05 | 877.2 | Suresh, C. G.; Gangamani, B. P.; Ganesh, K. N. The rare <i>trans</i>-<i>syn</i> thymine photodimers: structures of polyoxyethylene-linked bisthymines and the derived <i>trans</i>-<i>syn</i> thymine photodimers. Comparison of the stereochemistry before and after photodimerization Acta Crystallographica Section B, 1996, 52, 376-383 |
| 2101492 | CIF Paper | C16 H22 N4 O6 | P -1 | 7.9; 10.061; 12.048 71.37; 78.13; 72.17 | 857.6 | Suresh, C. G.; Gangamani, B. P.; Ganesh, K. N. The rare <i>trans</i>-<i>syn</i> thymine photodimers: structures of polyoxyethylene-linked bisthymines and the derived <i>trans</i>-<i>syn</i> thymine photodimers. Comparison of the stereochemistry before and after photodimerization Acta Crystallographica Section B, 1996, 52, 376-383 |
| 2101493 | CIF Paper | C20 H22 N4 O6 | P -1 | 8.558; 11.077; 11.437 108.57; 94.37; 99.77 | 1002.9 | Suresh, C. G.; Gangamani, B. P.; Ganesh, K. N. The rare <i>trans</i>-<i>syn</i> thymine photodimers: structures of polyoxyethylene-linked bisthymines and the derived <i>trans</i>-<i>syn</i> thymine photodimers. Comparison of the stereochemistry before and after photodimerization Acta Crystallographica Section B, 1996, 52, 376-383 |
| 2101494 | CIF Paper | C20 H22 N4 O6 | P 1 21/n 1 | 10.357; 14.578; 12.676 90; 97.99; 90 | 1895.3 | Suresh, C. G.; Gangamani, B. P.; Ganesh, K. N. The rare <i>trans</i>-<i>syn</i> thymine photodimers: structures of polyoxyethylene-linked bisthymines and the derived <i>trans</i>-<i>syn</i> thymine photodimers. Comparison of the stereochemistry before and after photodimerization Acta Crystallographica Section B, 1996, 52, 376-383 |
| 2101495 | CIF Paper | C21 H23 N3 O2 | P b c a | 34.845; 10.013; 10.918 90; 90; 90 | 3809 | André, C.; Luger, P.; Lotz, S.; Fehlhammer, W.-P. The crystal packing modes of three sterically overcrowded imidazole derivatives Acta Crystallographica Section B, 1996, 52, 369-375 |
| 2101496 | CIF Paper | C19 H21 N3 O2 | P 21 21 21 | 8.321; 12.411; 17.008 90; 90; 90 | 1756.4 | André, C.; Luger, P.; Lotz, S.; Fehlhammer, W.-P. The crystal packing modes of three sterically overcrowded imidazole derivatives Acta Crystallographica Section B, 1996, 52, 369-375 |
| 2101497 | CIF Paper | C19 H21 N3 | P 1 21/a 1 | 16.607; 11.427; 9.668 90; 114.38; 90 | 1671.1 | André, C.; Luger, P.; Lotz, S.; Fehlhammer, W.-P. The crystal packing modes of three sterically overcrowded imidazole derivatives Acta Crystallographica Section B, 1996, 52, 369-375 |
| 2101498 | CIF Paper | C18 H36 Cl2 N2 Pd2 S4 | P 1 21/a 1 | 16.393; 9.235; 11.176 90; 128.01; 90 | 1333 | Nyburg, S. C. Structure of a twin initially solved from a partial data set: di-μ-chlorobis-[di-<i>n</i>-butyldithiocarbamato]dipalladium Acta Crystallographica Section B, 1996, 52, 328-331 |
| 2101499 | CIF Paper | C | F d -3 m | 3.56658; 3.56658; 3.56658 90; 90; 90 | 45.3687 | Yamanaka, T.; Morimoto, S. Isotope effect on anharmonic thermal atomic vibration and κ refinement of ^12^C and ^3^C diamond Acta Crystallographica Section B, 1996, 52, 232-238 |
| 2101500 | CIF Paper | C4 H16 N Na O10 | P 21 21 2 | 12.206; 14.451; 6.25 90; 90; 90 | 1102.4 | Suzuki, E.; Muta, T.; Nozaki, R.; Shiozaki, Y. Modification of crystal structure of ammonium Rochelle salt [NaNH~4~(+)-C~4~H~4~O~6~.4H~2~O] owing to the replacement of NH~4~ ions with K ions Acta Crystallographica Section B, 1996, 52, 296-302 |
| 2101501 | CIF Paper | C4 H15.76 K0.06 N0.94 Na O10 | P 21 21 2 | 12.172; 14.421; 6.239 90; 90; 90 | 1095.2 | Suzuki, E.; Muta, T.; Nozaki, R.; Shiozaki, Y. Modification of crystal structure of ammonium Rochelle salt [NaNH~4~(+)-C~4~H~4~O~6~.4H~2~O] owing to the replacement of NH~4~ ions with K ions Acta Crystallographica Section B, 1996, 52, 296-302 |
| 2101502 | CIF Paper | C4 H15.6 K0.1 N0.9 Na O10 | P 21 21 2 | 12.165; 14.42; 6.239 90; 90; 90 | 1094 | Suzuki, E.; Muta, T.; Nozaki, R.; Shiozaki, Y. Modification of crystal structure of ammonium Rochelle salt [NaNH~4~(+)-C~4~H~4~O~6~.4H~2~O] owing to the replacement of NH~4~ ions with K ions Acta Crystallographica Section B, 1996, 52, 296-302 |
| 2101504 | CIF Paper | C10 H8 Cl N O2 | P 1 21/c 1 | 7.313; 17.156; 7.64 90; 92.71; 90 | 957.5 | Nigović, B.; Kojić-Prodić, B.; Antolić, S.; Tomić, S.; Puntarec, V.; Cohen, J. D. Structural studies on monohalogenated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 332-343 |
| 2101505 | CIF Paper | C10 H8 Cl N O2 | P 1 21/c 1 | 19.141; 5.154; 10.323 90; 116.23; 90 | 913.5 | Nigović, B.; Kojić-Prodić, B.; Antolić, S.; Tomić, S.; Puntarec, V.; Cohen, J. D. Structural studies on monohalogenated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 332-343 |
| 2101506 | CIF Paper | C10 H8 Cl N O2 | P b c a | 61.08; 12.115; 7.674 90; 90; 90 | 5679 | Nigović, B.; Kojić-Prodić, B.; Antolić, S.; Tomić, S.; Puntarec, V.; Cohen, J. D. Structural studies on monohalogenated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 332-343 |
| 2101507 | CIF Paper | C10 H8 Cl N O2 | P 1 21/c 1 | 20.244; 4.829; 10.728 90; 116.3; 90 | 940.2 | Nigović, B.; Kojić-Prodić, B.; Antolić, S.; Tomić, S.; Puntarec, V.; Cohen, J. D. Structural studies on monohalogenated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 332-343 |
| 2101508 | CIF Paper | C10 H8 Br N O2 | P -1 | 5.645; 9.713; 10.019 116.02; 92.67; 100.12 | 481.2 | Nigović, B.; Kojić-Prodić, B.; Antolić, S.; Tomić, S.; Puntarec, V.; Cohen, J. D. Structural studies on monohalogenated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 332-343 |
| 2101509 | CIF Paper | C4 H8 N O10 Ti | P 64 2 2 | 8.939; 8.939; 10.893 90; 90; 120 | 753.8 | Sheu, H. S.; Wu, J. C.; Wang, Y.; English, R. B. Charge density studies in NH~4~[Ti(C~2~O~4~)~2~].2H~2~O crystals at two wavelengths Acta Crystallographica Section B, 1996, 52, 458-464 |
| 2101510 | CIF Paper | C4 H8 N O10 Ti | P 64 2 2 | 8.931; 8.931; 10.893 90; 90; 120 | 752.5 | Sheu, H. S.; Wu, J. C.; Wang, Y.; English, R. B. Charge density studies in NH~4~[Ti(C~2~O~4~)~2~].2H~2~O crystals at two wavelengths Acta Crystallographica Section B, 1996, 52, 458-464 |
| 2101511 | CIF Paper | C4 H8 N O10 Ti | P 64 2 2 | 8.947; 8.947; 10.898 90; 90; 120 | 755.5 | Sheu, H. S.; Wu, J. C.; Wang, Y.; English, R. B. Charge density studies in NH~4~[Ti(C~2~O~4~)~2~].2H~2~O crystals at two wavelengths Acta Crystallographica Section B, 1996, 52, 458-464 |
| 2101512 | CIF Paper | Ho2 O3 | I a -3 | 10.605; 10.605; 10.605 90; 90; 90 | 1192.7 | Maslen, E. N.; Streltsov, V. A.; Ishizawa, N. A synchrotron X-ray study of the electron density in <i>C</i>-type rare earth oxides Acta Crystallographica Section B, 1996, 52, 414-422 |
| 2101513 | CIF Paper | C29 H29 Ta | P 3 1 c | 12.681; 12.681; 16.124 90; 90; 120 | 2245.5 | Schaefer, W. P.; Marsh, R. E.; Rodriguez, G.; Bazan, G. C. A tribenzylidenemethane‒tantalum compound: some experiences with `inversion twinning' Acta Crystallographica Section B, 1996, 52, 465-470 |
| 2101514 | CIF Paper | Bi2 Nb2 O9 Pb | A 21 a m | 5.503; 5.495; 25.531 90; 90; 90 | 772 | Srikanth, V.; Idink, H.; White, W. B.; Subbarao, E. C.; Rajagopal, H.; Sequeira, A. Cation disorder in ferroelectric PbBi~2~Nb~2~O~9~ Acta Crystallographica Section B, 1996, 52, 432-439 |
| 2101515 | CIF Paper | Bi2 Nb2 O9 Pb | A 21 a m | 5.504; 5.487; 25.511 90; 90; 90 | 770.4 | Srikanth, V.; Idink, H.; White, W. B.; Subbarao, E. C.; Rajagopal, H.; Sequeira, A. Cation disorder in ferroelectric PbBi~2~Nb~2~O~9~ Acta Crystallographica Section B, 1996, 52, 432-439 |
| 2101516 | CIF Paper | Co Na O4 P | P n m a | 8.871; 6.78; 5.023 90; 90; 90 | 302.11 | Hammond, R.; Barbier, J. Structural chemistry of NaCoPO~4~ Acta Crystallographica Section B, 1996, 52, 440-449 |
| 2101517 | CIF Paper | Co Na O4 P | P 65 | 10.166; 10.166; 23.881 90; 90; 120 | 2137.4 | Hammond, R.; Barbier, J. Structural chemistry of NaCoPO~4~ Acta Crystallographica Section B, 1996, 52, 440-449 |
| 2101518 | CIF Paper | C8 H4 N4 O6 | P 1 21/c 1 | 8.4668; 8.5533; 12.4657 90; 90.341; 90 | 902.74 | Kubicki, M.; Kindopp, T. W.; Capparelli, M. V.; Codding, P. W. Hydrogen-bond patterns in 1,4-dihydro-2,3-quinoxalinediones: ligands for the glycine modulatory site on the NMDA receptor Acta Crystallographica Section B, 1996, 52, 487-499 |
| 2101519 | CIF Paper | C8 H4 N4 O6 | P 21 21 21 | 6.9774; 13.083; 20.401 90; 90; 90 | 1862.3 | Kubicki, M.; Kindopp, T. W.; Capparelli, M. V.; Codding, P. W. Hydrogen-bond patterns in 1,4-dihydro-2,3-quinoxalinediones: ligands for the glycine modulatory site on the NMDA receptor Acta Crystallographica Section B, 1996, 52, 487-499 |
| 2101520 | CIF Paper | C8 H7 N3 O5 | P 1 21/n 1 | 7.4744; 11.9265; 10.491 90; 97.513; 90 | 927.18 | Kubicki, M.; Kindopp, T. W.; Capparelli, M. V.; Codding, P. W. Hydrogen-bond patterns in 1,4-dihydro-2,3-quinoxalinediones: ligands for the glycine modulatory site on the NMDA receptor Acta Crystallographica Section B, 1996, 52, 487-499 |
| 2101521 | CIF Paper | C8 H4 Cl2 N2 O2 | P 1 21/n 1 | 7.2066; 8.4502; 14.4709 90; 99.707; 90 | 868.62 | Kubicki, M.; Kindopp, T. W.; Capparelli, M. V.; Codding, P. W. Hydrogen-bond patterns in 1,4-dihydro-2,3-quinoxalinediones: ligands for the glycine modulatory site on the NMDA receptor Acta Crystallographica Section B, 1996, 52, 487-499 |
| 2101522 | CIF Paper | C11 H11 Cl2 N3 O3 | P -1 | 6.1501; 8.3787; 13.7356 107.407; 99.304; 95.032 | 659.5 | Kubicki, M.; Kindopp, T. W.; Capparelli, M. V.; Codding, P. W. Hydrogen-bond patterns in 1,4-dihydro-2,3-quinoxalinediones: ligands for the glycine modulatory site on the NMDA receptor Acta Crystallographica Section B, 1996, 52, 487-499 |
| 2101523 | CIF Paper | C8 H24 Co Li N8 O12 | P -3 m 1 | 8.856; 8.856; 7.017 90; 90; 120 | 476.6 | Bianchi, R.; Gatti, C.; Adovasio, V.; Nardelli, M. Theoretical and experimental (113 K) electron-density study of lithium bis(tetramethylammonium) hexanitrocobaltate(III) Acta Crystallographica Section B, 1996, 52, 471-478 |
| 2101524 | CIF Paper | C8 H24 Co Li N8 O12 | P -3 m 1 | 8.856; 8.856; 7.017 90; 90; 120 | 476.6 | Bianchi, R.; Gatti, C.; Adovasio, V.; Nardelli, M. Theoretical and experimental (113 K) electron-density study of lithium bis(tetramethylammonium) hexanitrocobaltate(III) Acta Crystallographica Section B, 1996, 52, 471-478 |
| 2101526 | CIF Paper | C4 H8 O3 S | P 21 21 21 | 7.204; 13.67; 6.041 90; 90; 90 | 594.9 | Hellier, D.G.; Luger, P.; Buschmann, J. Chemistry of the S=O bond. 13. Structures of isomers 1 (I) and 2 (II) of 4-methyl-1,3,2-dioxathiane 2-oxide and 1,3,2-dioxathiepane 2-oxide (III) at 256, 240 and 228 K Acta Crystallographica Section B, 1996, 52, 505-508 |
| 2101527 | CIF Paper | C4 H8 O3 S | P 21 21 21 | 18.238; 10.265; 6.616 90; 90; 90 | 1238.6 | Hellier, D.G.; Luger, P.; Buschmann, J. Chemistry of the S=O bond. 13. Structures of isomers 1 (I) and 2 (II) of 4-methyl-1,3,2-dioxathiane 2-oxide and 1,3,2-dioxathiepane 2-oxide (III) at 256, 240 and 228 K Acta Crystallographica Section B, 1996, 52, 505-508 |
| 2101528 | CIF Paper | C4 H8 O3 S | P 1 21/n 1 | 6.06; 11.185; 9.186 90; 101.32; 90 | 610.5 | Hellier, D.G.; Luger, P.; Buschmann, J. Chemistry of the S=O bond. 13. Structures of isomers 1 (I) and 2 (II) of 4-methyl-1,3,2-dioxathiane 2-oxide and 1,3,2-dioxathiepane 2-oxide (III) at 256, 240 and 228 K Acta Crystallographica Section B, 1996, 52, 505-508 |
| 2101529 | CIF Paper | C21 H25 Cl N2 O4 | P 21 21 21 | 7.81; 15.007; 18.326 90; 90; 90 | 2147.9 | Declercq, J.-P.; Dubourg, A.; Payrastre, C.; Mazières, M.-R.; Madaule, Y.; Wolf, J.-G. Structure of 1,5-bis(dimethylamino)-1,5-diphenylpentadienylium perchlorate and modelling of pentadienylium salts (cyanine dyes) Acta Crystallographica Section B, 1996, 52, 500-504 |
| 2101530 | CIF Paper | C27 H50 O6 | P 21 21 21 | 6.234; 15.628; 30.749 90; 90; 90 | 2995.7 | Suwińska, K.; Kutner, A. Crystal and molecular structure of 1,25-dihydroxycholecalciferol Acta Crystallographica Section B, 1996, 52, 550-554 |
| 2101531 | CIF Paper | C23 H29 Br N3 O3.5 | C 1 2/c 1 | 21.916; 15.207; 14.052 90; 101.56; 90 | 4588.2 | Dalpiaz, A.; Ferretti, V.; Gilli, P.; Bertolasi, V. Stereochemistry of serotonin receptor ligands from crystallographic data. Crystal structures of NAN-190.HBr, 1-phenylbiguanide, MDL 72222 and mianserin.HCl and selectivity criteria towards 5-HT~1~, 5-HT~2~ and 5-HT~3~ receptor subtypes Acta Crystallographica Section B, 1996, 52, 509-518 |
| 2101532 | CIF Paper | C8 H11 N5 | P 1 21/c 1 | 9.781; 35.04; 11 90; 97.72; 90 | 3735.8 | Dalpiaz, A.; Ferretti, V.; Gilli, P.; Bertolasi, V. Stereochemistry of serotonin receptor ligands from crystallographic data. Crystal structures of NAN-190.HBr, 1-phenylbiguanide, MDL 72222 and mianserin.HCl and selectivity criteria towards 5-HT~1~, 5-HT~2~ and 5-HT~3~ receptor subtypes Acta Crystallographica Section B, 1996, 52, 509-518 |
| 2101533 | CIF Paper | C15 H17 Cl2 N O2 | P -1 | 8.48; 9.84; 10.158 90.04; 111.77; 105.07 | 755.6 | Dalpiaz, A.; Ferretti, V.; Gilli, P.; Bertolasi, V. Stereochemistry of serotonin receptor ligands from crystallographic data. Crystal structures of NAN-190.HBr, 1-phenylbiguanide, MDL 72222 and mianserin.HCl and selectivity criteria towards 5-HT~1~, 5-HT~2~ and 5-HT~3~ receptor subtypes Acta Crystallographica Section B, 1996, 52, 509-518 |
| 2101534 | CIF Paper | C18 H21 Cl N2 | P 1 21/a 1 | 9.014; 14.917; 12.412 90; 108.84; 90 | 1579.5 | Dalpiaz, A.; Ferretti, V.; Gilli, P.; Bertolasi, V. Stereochemistry of serotonin receptor ligands from crystallographic data. Crystal structures of NAN-190.HBr, 1-phenylbiguanide, MDL 72222 and mianserin.HCl and selectivity criteria towards 5-HT~1~, 5-HT~2~ and 5-HT~3~ receptor subtypes Acta Crystallographica Section B, 1996, 52, 509-518 |
| 2101535 | CIF Paper | Fe3 O4 | F d -3 m {origin @ centre (-3m)} | 8.3922; 8.3922; 8.3922 90; 90; 90 | 591.05 | Okudera, H.; Kihara, K.; Matsumoto, T. Temperature dependence of structure parameters in natural magnetite: single crystal X-ray studies from 126 to 773 K Acta Crystallographica Section B, 1996, 52, 450-457 |
| 2101536 | CIF Paper | C6 H19 N4 O7 P | P 1 21 1 | 7.333; 7.93; 10.81 90; 98; 90 | 622.5 | Espinosa, E.; Lecomte, C.; Molins, E.; Veintemillas, S.; Cousson, A.; Paulus, W. Electron density study of a new non-linear optical material: <small>L</small>-arginine phosphate monohydrate (LAP). Comparison between <i>X</i>‒<i>X</i> and <i>X</i>‒(<i>X</i> + <i>N</i>) refinements Acta Crystallographica Section B, 1996, 52, 519-534 |
| 2101537 | CIF Paper | C6 H19 N4 O7 P | P 1 21 1 | 7.319; 7.912; 10.779 90; 98.05; 90 | 618 | Espinosa, E.; Lecomte, C.; Molins, E.; Veintemillas, S.; Cousson, A.; Paulus, W. Electron density study of a new non-linear optical material: <small>L</small>-arginine phosphate monohydrate (LAP). Comparison between <i>X</i>‒<i>X</i> and <i>X</i>‒(<i>X</i> + <i>N</i>) refinements Acta Crystallographica Section B, 1996, 52, 519-534 |
| 2101538 | CIF Paper | C6 H19 N4 O7 P | P 1 21 1 | 7.319; 7.912; 10.779 90; 98.05; 90 | 618 | Espinosa, E.; Lecomte, C.; Molins, E.; Veintemillas, S.; Cousson, A.; Paulus, W. Electron density study of a new non-linear optical material: <small>L</small>-arginine phosphate monohydrate (LAP). Comparison between <i>X</i>‒<i>X</i> and <i>X</i>‒(<i>X</i> + <i>N</i>) refinements Acta Crystallographica Section B, 1996, 52, 519-534 |
| 2101539 | CIF Paper | H I O Sr | P n m a | 7.7294; 4.24697; 10.7374 90; 90; 90 | 352.472 | Peter, S.; Cockcroft, J. K.; Roisnel, T.; Lutz, H. D. Distance limits of OH···<i>Y</i> hydrogen bonds (<i>Y</i> = Cl, Br, I) in solid hydroxides, structure refinement of laurionite-type Ba(OD)I, Sr(OD)I and Sr(OH)I by neutron and synchrotron X-ray powder diffraction Acta Crystallographica Section B, 1996, 52, 423-427 |
| 2101540 | CIF Paper | C7 H8 K2 O7 S2 | P 1 21/c 1 | 10.674; 10.79; 10.543 90; 99.97; 90 | 1195.9 | Nagel, N.; Eller, P.; Bock, H. Benzene-1,2-disulfonate dianion: another compound with meshed cogwheel substituents? Acta Crystallographica Section B, 1996, 52, 562-568 |
| 2101541 | CIF Paper | C10 H17 K N O6.5 S2 | P 1 21/m 1 | 10.891; 6.657; 21.212 90; 101.64; 90 | 1506.3 | Nagel, N.; Eller, P.; Bock, H. Benzene-1,2-disulfonate dianion: another compound with meshed cogwheel substituents? Acta Crystallographica Section B, 1996, 52, 562-568 |
| 2101542 | CIF Paper | C11 H14 N6 | P -1 | 10.717; 7.762; 7.418 71.078; 82.838; 78.941 | 571.585 | Karfunkel, H. R.; Wu, Z. J.; Burkhard, A.; Rihs, G.; Sinnreich, D.; Buerger, H. M.; Stanek, J. Crystal packing calculations and Rietveld refinement in elucidating the crystal structures of two modifications of 4-amidinoindanone guanylhydrazone Acta Crystallographica Section B, 1996, 52, 555-561 |
| 2101543 | CIF Paper | C11 H14 N6 | P 1 21/c 1 | 8.09; 7.929; 17.518 90; 90; 90 | 1123.7 | Karfunkel, H. R.; Wu, Z. J.; Burkhard, A.; Rihs, G.; Sinnreich, D.; Buerger, H. M.; Stanek, J. Crystal packing calculations and Rietveld refinement in elucidating the crystal structures of two modifications of 4-amidinoindanone guanylhydrazone Acta Crystallographica Section B, 1996, 52, 555-561 |
| 2101544 | CIF Paper | C18 H20 Cl2 N2 O4 | P n m a | 18.086; 6.983; 14.363 90; 90; 90 | 1814 | Wozniak, K.; Wilson, C. C.; Knight, K. S.; Jones, W.; Grech, E. Neutron diffraction of a complex of 1,8-bis(dimethylamino)naphthalene with 1,2-dichloromaleic acid Acta Crystallographica Section B, 1996, 52, 691-696 |
| 2101545 | CIF Paper | Ba Cu O5 Y2 | P n m a | 12.1793; 5.6591; 7.1323 90; 90; 90 | 491.59 | Hsu, Rebekah M.; Maslen, Edward N.; Ishizawa, Nobuo A synchrotron X-ray study of the electron density in Y~2~BaCuO~5~ Acta Crystallographica Section B, 1996, 52, 569-575 |
| 2101546 | CIF Paper | C28 H51 N O5 | P 1 21 1 | 13.226; 7.871; 14.028 90; 104.71; 90 | 1412.5 | Briozzo, P.; Kondo, T.; Sada, K.; Miyata, M.; Miki, K. Structures of three inclusion compounds of cholanamide with either (<i>S</i>)-enantiomer, (<i>R</i>)-enantiomer or an optically resolved mixture of butan-2-ol Acta Crystallographica Section B, 1996, 52, 728-733 |
| 2101547 | CIF Paper | C28 H51 N O5 | P 1 21 1 | 13.286; 7.853; 14.075 90; 105.12; 90 | 1417.7 | Briozzo, P.; Kondo, T.; Sada, K.; Miyata, M.; Miki, K. Structures of three inclusion compounds of cholanamide with either (<i>S</i>)-enantiomer, (<i>R</i>)-enantiomer or an optically resolved mixture of butan-2-ol Acta Crystallographica Section B, 1996, 52, 728-733 |
| 2101548 | CIF Paper | C28 H51 N O5 | P 1 21 1 | 13.251; 7.869; 14.045 90; 104.82; 90 | 1415.8 | Briozzo, P.; Kondo, T.; Sada, K.; Miyata, M.; Miki, K. Structures of three inclusion compounds of cholanamide with either (<i>S</i>)-enantiomer, (<i>R</i>)-enantiomer or an optically resolved mixture of butan-2-ol Acta Crystallographica Section B, 1996, 52, 728-733 |
| 2101549 | CIF Paper | Cl La O | P 4/n m m :2 | 4.1198; 4.1198; 6.8831 90; 90; 90 | 116.83 | E. N. Maslen; V. A. Streltsov; N. R. Streltsova; N. Ishizawa Synchrotron X-ray electron density in the layered LaOCl structure Acta Crystallographica Section B, 1996, 52, 576-579 |
| 2101550 | CIF Paper | C11 H12 N2 O2 | P 1 21/c 1 | 11.376; 6.4421; 14.419 90; 90.01; 90 | 1056.7 | Halcrow, M. A.; Powell, H. R.; Duer, M. J. Tautomerism in 3{5}-(dimethoxyphenyl)pyrazoles Acta Crystallographica Section B, 1996, 52, 746-752 |
| 2101551 | CIF Paper | C11 H13 N2 O2.5 | C 1 2/c 1 | 30.524; 8.9917; 8.1542 90; 101.057; 90 | 2196.5 | Halcrow, M. A.; Powell, H. R.; Duer, M. J. Tautomerism in 3{5}-(dimethoxyphenyl)pyrazoles Acta Crystallographica Section B, 1996, 52, 746-752 |
| 2101552 | CIF Paper | C4 H4 F8 N3 O2 P3 | P -1 | 12.392; 16.569; 19.257 110.22; 90.02; 97.1 | 3677.8 | Wang, Z.; Willett, R. D.; Elias, A. J.; Kirchmeier, R. L.; Shreeve, J. M. Structure of the polytypic β-form of P~3~N~3~(OCH~2~CF~2~CF~2~CH~2~O)F~4~ Acta Crystallographica Section B, 1996, 52, 643-650 |
| 2101553 | CIF HKL Paper | C16 H12 Cl F3 N2 O2 S | P 1 21/c 1 | 6.0144; 22.4675; 12.0544 90; 91.224; 90 | 1628.52 | Brock, C. P.; DeLaLuz, P. J.; Golinski, M.; Lloyd, M. A.; Vanaman, T. C.; Watt, D. S. Planarity of nitro-substituted phenothiazines Acta Crystallographica Section B, 1996, 52, 713-719 |
| 2101554 | CIF HKL Paper | C16 H15 Cl N2 O2 S | P 1 21/c 1 | 9.3191; 18.4382; 9.206 90; 104.004; 90 | 1534.8 | Brock, C. P.; DeLaLuz, P. J.; Golinski, M.; Lloyd, M. A.; Vanaman, T. C.; Watt, D. S. Planarity of nitro-substituted phenothiazines Acta Crystallographica Section B, 1996, 52, 713-719 |
| 2101555 | CIF Paper | C12 H5 F3 N2 O2 S | P -1 | 6.9087; 11.9009; 14.3626 85.715; 78.994; 82.86 | 1148.6 | Brock, C. P.; DeLaLuz, P. J.; Golinski, M.; Lloyd, M. A.; Vanaman, T. C.; Watt, D. S. Planarity of nitro-substituted phenothiazines Acta Crystallographica Section B, 1996, 52, 713-719 |
| 2101556 | CIF Paper | Al3 Cl Na4 O12 Si3 | P -4 3 n | 8.882; 8.882; 8.882 90; 90; 90 | 700.7 | McMullan, R. K.; Ghose, S.; Haga, N.; Schomaker, V. Sodalite, Na~4~Si~3~Al~3~O~12~Cl: structure and ionic mobility at high temperatures by neutron diffraction Acta Crystallographica Section B, 1996, 52, 616-627 |
| 2101557 | CIF Paper | C9 H10 Cl2 N2 O | P 1 21/a 1 | 9.191; 14.632; 7.738 90; 101.32; 90 | 1020.38 | Pfefer, G.; Boistelle, R. Experimental and theoretical morphologies of diuron, <i>N</i>'-(3,4-dichlorophenyl)-<i>N</i>,<i>N</i>-dimethylurea Acta Crystallographica, Section B: Structural Science, 1996, 52, 662-667 |
| 2101558 | CIF Paper | C8 H10 O2 | P 1 21/c 1 | 6.386; 11.264; 10.105 90; 103.78; 90 | 705.95 | Yufit, D. S.; Mallinson, P. R.; Muir, K. W.; Kozhushkov, S. I.; De Meijere, A. Experimental charge density study of 7-dispiro[2.0.2.1]heptane carboxylic acid Acta Crystallographica Section B, 1996, 52, 668-676 |
| 2101559 | CIF Paper | O6 Sb2 W | F -1 | 11.132; 9.896; 18.482 90.2; 96.87; 90.21 | 2021.4 | Ling, C. D.; Withers, R. L.; Rae, A. D.; Schmid, S.; Thompson, J. G. Antiferroelectric modulations in Sb~2~WO~6~ and Sb~2~MoO~6~ Acta Crystallographica Section B, 1996, 52, 610-615 |
| 2101560 | CIF Paper | Bi2 Rh | P -1 | 6.743; 7.03; 7.067 104.76; 100.73; 105.79 | 299.74 | Ruck, M. Kristallstruktur und zwillingsbildung der intermetallischen phase β-Bi~2~Rh Acta Crystallographica Section B, 1996, 52, 605-609 |
| 2101561 | CIF Paper | C10 H8 F N O2 | C 1 2/c 1 | 17.294; 13.875; 7.442 90; 103.88; 90 | 1733.6 | Antolić, A.; Kojić-Prodić, B.; Tomić, S.; Nigović, B.; Magnus, V.; Cohen, J. D. Structural studies on monofluorinated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 651-661 |
| 2101562 | CIF Paper | C10 H8 F N O2 | P 1 21/c 1 | 19.284; 5.083; 9.939 90; 117.28; 90 | 865.9 | Antolić, A.; Kojić-Prodić, B.; Tomić, S.; Nigović, B.; Magnus, V.; Cohen, J. D. Structural studies on monofluorinated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 651-661 |
| 2101563 | CIF Paper | C10 H8 F N O2 | P 1 21/a 1 | 9.36; 5.167; 17.751 90; 93.75; 90 | 856.7 | Antolić, A.; Kojić-Prodić, B.; Tomić, S.; Nigović, B.; Magnus, V.; Cohen, J. D. Structural studies on monofluorinated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 651-661 |
| 2101564 | CIF Paper | C10 H8 F N O2 | P 1 21/a 1 | 9.935; 5.0059; 17.61 90; 102.13; 90 | 856.3 | Antolić, A.; Kojić-Prodić, B.; Tomić, S.; Nigović, B.; Magnus, V.; Cohen, J. D. Structural studies on monofluorinated derivatives of the phytohormone indole-3-acetic acid (auxin) Acta Crystallographica Section B, 1996, 52, 651-661 |
| 2101565 | CIF Paper | C12 H12 Br2 O6 | P 1 21/n 1 | 9.622; 7.853; 19.103 90; 93.11; 90 | 1441.3 | Näther, C.; Nagel, N.; Bock, H.; Seitz, W.; Havlas, Z. Structural, kinetic and thermodynamic aspects of the conformational dimorphism of diethyl 3,6-dibromo-2,5-dihydroxyterephthalate Acta Crystallographica Section B, 1996, 52, 697-706 |
| 2101566 | CIF Paper | C12 H12 Br2 O6 | P 1 21/c 1 | 8.267; 25.037; 7.526 90; 113.44; 90 | 1429.2 | Näther, C.; Nagel, N.; Bock, H.; Seitz, W.; Havlas, Z. Structural, kinetic and thermodynamic aspects of the conformational dimorphism of diethyl 3,6-dibromo-2,5-dihydroxyterephthalate Acta Crystallographica Section B, 1996, 52, 697-706 |
| 2101567 | CIF Paper | C16 H24 Br2 O8 | P -1 | 8.002; 8.232; 8.966 116.82; 96.1; 102.29 | 500.9 | Näther, C.; Nagel, N.; Bock, H.; Seitz, W.; Havlas, Z. Structural, kinetic and thermodynamic aspects of the conformational dimorphism of diethyl 3,6-dibromo-2,5-dihydroxyterephthalate Acta Crystallographica Section B, 1996, 52, 697-706 |
| 2101568 | CIF Paper | Ce2 Ga15 Pt6 | P 63/m m c | 4.3267; 4.3267; 16.5369 90; 90; 120 | 268.1 | Kwei, G. H.; Lawson, A. C.; Larson, A. C.; Morosin, B.; Larson, E. M.; Canfield, P. C. Structure of Ce~2~Pt~6~Ga~15~: interplanar disorder from the Ce~2~Ga~3~ layers Acta Crystallographica Section B, 1996, 52, 580-585 |
| 2101569 | CIF Paper | Ce2 Ga15 Pt6 | P 63/m m c | 4.335; 4.335; 16.564 90; 90; 120 | 269.6 | Kwei, G. H.; Lawson, A. C.; Larson, A. C.; Morosin, B.; Larson, E. M.; Canfield, P. C. Structure of Ce~2~Pt~6~Ga~15~: interplanar disorder from the Ce~2~Ga~3~ layers Acta Crystallographica Section B, 1996, 52, 580-585 |
| 2101570 | CIF Paper | Ce2 Ga15 Pt6 | P 63/m m c | 4.3259; 4.3259; 16.522 90; 90; 120 | 267.76 | Kwei, G. H.; Lawson, A. C.; Larson, A. C.; Morosin, B.; Larson, E. M.; Canfield, P. C. Structure of Ce~2~Pt~6~Ga~15~: interplanar disorder from the Ce~2~Ga~3~ layers Acta Crystallographica Section B, 1996, 52, 580-585 |
| 2101571 | CIF Paper | C12 H15 N O4 | C 1 2/c 1 | 10.03; 9.84; 21.625 90; 90.87; 90 | 2134 | Kruger, H. G.; Martins, F. J. C.; Viljoen, A. M.; Boeyens, J. C. A.; Cook, L. M.; Levendis, D. C. Structure and conformation of the hydrate of 8,11-dihydroxypentacyclo[5.4.0.0^2,6^.0^3,10^.0^5,9^]undecane-8,11-carbolactam Acta Crystallographica Section B, 1996, 52, 838-841 |
| 2101572 | CIF Paper | C H8 F6 N4 Zr | P b a 2 | 10.089; 18.349; 7.56 90; 90; 90 | 1399.5 | Abrahams, S. C.; Mirsky, K.; Nielson, R. M. Prediction of ferroelectricity in recent Inorganic Crystal Structure Database entries under space group <i>Pba</i>2 Acta Crystallographica Section B, 1996, 52, 806-809 |
| 2101573 | CIF Paper | Ba0.6 Bi K0.4 O2.3 | P b a 2 | 6.127; 12.016; 4.378 90; 90; 90 | 322.317 | Abrahams, S. C.; Mirsky, K.; Nielson, R. M. Prediction of ferroelectricity in recent Inorganic Crystal Structure Database entries under space group <i>Pba</i>2 Acta Crystallographica Section B, 1996, 52, 806-809 |
| 2101574 | CIF Paper | Cl10 Mo N O P2 | P b a 2 | 15.984; 11.412; 4.151 90; 90; 90 | 757.2 | Abrahams, S. C.; Mirsky, K.; Nielson, R. M. Prediction of ferroelectricity in recent Inorganic Crystal Structure Database entries under space group <i>Pba</i>2 Acta Crystallographica Section B, 1996, 52, 806-809 |
| 2101575 | CIF Paper | C4 Br0.3 D6 K2 N4 O3 Pt | P 4 m m | 9.897; 9.897; 5.784 90; 90; 90 | 566.5 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101576 | CIF Paper | Ba Cu Fe O5 Y | P 4 m m | 3.865; 3.865; 7.6425 90; 90; 90 | 114.17 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101577 | CIF Paper | Ba2 O8 Si2 Ti | P 4 b m | 8.527; 8.527; 5.2104 90; 90; 90 | 378.85 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101578 | CIF Paper | N2 S4 | P 42 n m | 11.146; 11.146; 3.773 90; 90; 90 | 468.7 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101579 | CIF Paper | As2 Ba Ge2 | P 42 m c | 7.618; 7.618; 8.5 90; 90; 90 | 493.3 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101580 | CIF Paper | Pu S2 | P 4 m m | 3.943; 3.943; 7.962 90; 90; 90 | 123.8 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101581 | CIF Paper | Cl3 Cs Eu | P 4 m m | 5.588; 5.588; 5.619 90; 90; 90 | 175.5 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101582 | CIF Paper | Nd0.33 O3 Ta | P 4 m m | 7.822; 7.822; 3.883 90; 90; 90 | 237.58 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101583 | CIF Paper | Mn0.04 Ni0.04 O3 Pb Ti0.04 Zr0.44 | P 4 m m | 4.0382; 4.0382; 4.1057 90; 90; 90 | 66.952 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101584 | CIF Paper | Ba Cl Cu K O7 V2 | P 4 b m | 8.8581; 8.8581; 5.4711 90; 90; 90 | 429.29 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101585 | CIF Paper | Ba6 Co Nb9 O30 | P 4 b m | 12.589; 12.589; 4.009 90; 90; 90 | 635.358 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101586 | CIF Paper | K2 Nb2 O14 Si4 | P 4 b m | 8.7404; 8.7404; 8.136 90; 90; 90 | 621.55 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101587 | CIF Paper | Cr N Nb | P 4 b m | 4.283; 4.283; 7.36 90; 90; 90 | 135.012 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101588 | CIF Paper | K2 O7 Zn6 | P 42 n m | 10.912; 10.912; 3.325 90; 90; 90 | 395.914 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101589 | CIF Paper | O6 Se2 V | P 4 c c | 11.22; 11.22; 7.86 90; 90; 90 | 989 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101590 | CIF Paper | H3 Na O3 Zn | P 42 b c | 10.839; 10.839; 5.308 90; 90; 90 | 623.6 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101591 | CIF Paper | Mn O6 Sb Sr2 | I 4 m m | 5.526; 5.526; 8.039 90; 90; 90 | 245.48 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101592 | CIF Paper | Cu K Na2 O2 | I 4 m m | 4.327; 4.327; 10.891 90; 90; 90 | 203.9 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101593 | CIF Paper | Cl6 H3 In K3 O1.5 | I 4 m m | 16.563; 16.563; 18.563 90; 90; 90 | 5092 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101594 | CIF Paper | K1.14 Mg0.57 O4 Si1.43 | I 4 m m | 8.957; 8.957; 5.281 90; 90; 90 | 423.68 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101595 | CIF Paper | Al F5 H4 Hg2 O4 | I 4 c m | 9.353; 9.353; 7.241 90; 90; 90 | 633.4 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101596 | CIF Paper | F18 Nb3 O Rb5 | I 4 c m | 15.525; 15.525; 7.794 90; 90; 90 | 1878.6 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101597 | CIF Paper | Ag S2 Yb | I 41 m d | 5.356; 5.356; 11.803 90; 90; 90 | 338.59 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101598 | CIF Paper | Ni2 O8 Sr V2 | I 41 c d | 12.1617; 12.1617; 8.3247 90; 90; 90 | 1231.3 | Abrahams, S. C. New ferroelectric inorganic materials predicted in point group 4<i>mm</i> Acta Crystallographica Section B, 1996, 52, 790-805 |
| 2101599 | CIF Paper | C D3 F | P 1 21/n 1 | 6.4373; 7.5023; 3.9598 90; 101.842; 90 | 187.167 | Ibberson, R. M.; Prager, M. The <i>ab initio</i> crystal structure determination of vapour-deposited methyl fluoride by high-resolution neutron powder diffraction Acta Crystallographica Section B, 1996, 52, 892-895 |
| 2101600 | CIF Paper | H4 O9 P2 Ti | P 1 21/c 1 | 8.611; 4.9933; 16.1507 90; 110.206; 90 | 651.7 | Salvadó, M. A.; Pertierra, P.; García-Granda, S.; García, J. R.; Rodríguez, J.; Fernández-Díaz, M. T. Neutron powder diffraction study of α-Ti(HPO~4~)~2~.H~2~O and α-Hf(HPO~4~)~2~.H~2~O; H-atom positions Acta Crystallographica Section B, 1996, 52, 896-898 |
| 2101601 | CIF Paper | H4 Hf O9 P2 | P 1 21/c 1 | 8.9955; 5.2439; 16.224 90; 111.234; 90 | 713.37 | Salvadó, M. A.; Pertierra, P.; García-Granda, S.; García, J. R.; Rodríguez, J.; Fernández-Díaz, M. T. Neutron powder diffraction study of α-Ti(HPO~4~)~2~.H~2~O and α-Hf(HPO~4~)~2~.H~2~O; H-atom positions Acta Crystallographica Section B, 1996, 52, 896-898 |
| 2101602 | CIF Paper | C12 H8 N4 Pt | C m c m | 18.142; 9.361; 6.659 90; 90; 90 | 1130.9 | Connick, W. B.; Henling, L. M.; Marsh, R. E. A revision of the structure of (bipyridyl-<i>N</i>,<i>N</i>')-dicyanoplatinum(II) Acta Crystallographica Section B, 1996, 52, 817-822 |
| 2101603 | CIF Paper | C21 H46 N3 O7 P | P 21 21 21 | 16.7042; 24.4881; 6.3891 90; 90; 90 | 2613.49 | Souhassou, M.; Schaber, P. M.; Blessing, R. H. Structure of tris(cyclohexylammonium) phosphoenolpyruvate monohydrate and crystal chemistry of phosphoenolpyruvates Acta Crystallographica Section B, 1996, 52, 865-875 |
| 2101604 | CIF Paper | C8 Cl4 D32 I2 N8 O16 Pt2 | C 1 2/c 1 | 16.65; 5.76; 14.751 90; 99.19; 90 | 1396.5 | Bardeau, J.-F.; Bulou, A.; Klooster, W. T.; Koetzle, T. F.; Johnson, S.; Scott, B.; Swanson, B. I.; Eckert, J. Neutron diffraction study of [Pt(en)~2~][Pt(en)~2~I~2~](ClO~4~)~4~ at 20 K: structure and evidence of a new phase transition Acta Crystallographica Section B, 1996, 52, 854-864 |
| 2101605 | CIF Paper | Ba0.85 Ca2.15 In6 O12 | P 63/m | 9.888; 9.888; 3.217 90; 90; 120 | 272.395 | Baldinozzi, G.; Goutenoire, F.; Hervieu, M.; Suard, E.; Grebille, D. Incommensurate modulated disorder in Ba~0.85~Ca~2.15~In~6~O~12~ Acta Crystallographica Section B, 1996, 52, 780-789 |
| 2101606 | CIF Paper | C5 Ca Cl2 D15 N O4 | P n m a | 10.95; 10.15; 10.82 90; 90; 90 | 1203 | Ezpeleta, J. M.; Zúñiga, F. J.; Paulus, W.; Cousson, A.; Hlinka, J.; Quilichini, M. Structures of room-temperature and ferroelectric (35 K) phases of deuterated betaine calcium chloride dihydrate Acta Crystallographica Section B, 1996, 52, 810-816 |
| 2101607 | CIF Paper | C5 Ca Cl2 D15 N O4 | P n 21 a | 10.905; 10; 10.8 90; 90; 90 | 1177.7 | Ezpeleta, J. M.; Zúñiga, F. J.; Paulus, W.; Cousson, A.; Hlinka, J.; Quilichini, M. Structures of room-temperature and ferroelectric (35 K) phases of deuterated betaine calcium chloride dihydrate Acta Crystallographica Section B, 1996, 52, 810-816 |
| 2101608 | CIF Paper | C8 H13 N3 O5 | P 1 21/c 1 | 5.248; 26.485; 7.248 90; 95.47; 90 | 1002.8 | Suresh, S.; Vijayan, M. X-ray studies on crystalline complexes involving amino acids and peptides. XXX. Structural invariance and optical resolution through interactions with an achiral molecule in the histidine complexes of glycolic acid Acta Crystallographica Section B, 1996, 52, 876-881 |
| 2101609 | CIF Paper | C8 H13 N3 O5 | P 21 21 21 | 5.084; 11.012; 17.899 90; 90; 90 | 1002.1 | Suresh, S.; Vijayan, M. X-ray studies on crystalline complexes involving amino acids and peptides. XXX. Structural invariance and optical resolution through interactions with an achiral molecule in the histidine complexes of glycolic acid Acta Crystallographica Section B, 1996, 52, 876-881 |
| 2101610 | CIF Paper | K Li O5 Si2 | P 1 21 1 | 5.9803; 4.7996; 8.1599 90; 93.477; 90 | 233.78 | de Jong, B. H. W. S.; Supèr, H. T. J.; Spek, A. L.; Veldman, N.; van Wezel, W.; van der Mee, V. Structure of KLiSi~2~O~5~ and the hygroscopicity of glassy mixed alkali disilicates Acta Crystallographica Section B, 1996, 52, 770-776 |
| 2101611 | CIF Paper | C16 H14 F3 N O3 S | P 1 21/n 1 | 6.816; 23.687; 9.966 90; 106.63; 90 | 1541.7 | Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Alihodžić, Sulejman; Trinajstić, Nenad Bond length‒bond order relations and calculated geometries for some benzenoid aromatics, including phenanthridine. Structures of 5,6-dimethylphenanthridinium triflate, [<i>N</i>-(6-phenanthridinylmethyl)-aza-18-crown-6-κ^5^<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''',<i>O</i>''''](picrate-κ^2^-<i>O</i>,<i>O</i>')potassium, and [<i>N</i>,<i>N</i>'-bis(6-phenanthridinyl-κ<i>N</i>-methyl)-7,16-diaza-18-crown-6-κ^4^<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''']sodium iodide dichloromethane solvate Acta Crystallographica Section B, 1996, 52, 823-837 |
| 2101612 | CIF Paper | C32 H36 K N5 O12 | P -1 | 9.189; 11.786; 15.805 83.39; 88.29; 75.78 | 1648.2 | Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Alihodžić, Sulejman; Trinajstić, Nenad Bond length‒bond order relations and calculated geometries for some benzenoid aromatics, including phenanthridine. Structures of 5,6-dimethylphenanthridinium triflate, [<i>N</i>-(6-phenanthridinylmethyl)-aza-18-crown-6-κ^5^<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''',<i>O</i>''''](picrate-κ^2^-<i>O</i>,<i>O</i>')potassium, and [<i>N</i>,<i>N</i>'-bis(6-phenanthridinyl-κ<i>N</i>-methyl)-7,16-diaza-18-crown-6-κ^4^<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''']sodium iodide dichloromethane solvate Acta Crystallographica Section B, 1996, 52, 823-837 |
| 2101613 | CIF Paper | C41 H46 Cl2 I N4 Na O4 | I 2 2 2 | 10.453; 13.417; 28.526 90; 90; 90 | 4000.7 | Kojić-Prodić, Biserka; Kiralj, Rudolf; Žinić, Mladen; Alihodžić, Sulejman; Trinajstić, Nenad Bond length‒bond order relations and calculated geometries for some benzenoid aromatics, including phenanthridine. Structures of 5,6-dimethylphenanthridinium triflate, [<i>N</i>-(6-phenanthridinylmethyl)-aza-18-crown-6-κ^5^<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''',<i>O</i>''''](picrate-κ^2^-<i>O</i>,<i>O</i>')potassium, and [<i>N</i>,<i>N</i>'-bis(6-phenanthridinyl-κ<i>N</i>-methyl)-7,16-diaza-18-crown-6-κ^4^<i>O</i>,<i>O</i>',<i>O</i>'',<i>O</i>''']sodium iodide dichloromethane solvate Acta Crystallographica Section B, 1996, 52, 823-837 |
| 2101614 | CIF Paper | C10 H9 N3 | P 1 21/c 1 | 8.958; 8.161; 24.104 90; 98.98; 90 | 1740.6 | Schödel, H.; Näther, C.; Bock, H.; Butenschön, F. Trimorphism of 2,2'-dipyridylamine: structures, phase transitions and thermodynamic stabilities Acta Crystallographica Section B, 1996, 52, 842-853 |
| 2101615 | CIF Paper | C10 H9 N3 | P 1 21/c 1 | 9.001; 8.262; 24.234 90; 98.88; 90 | 1780.6 | Schödel, H.; Näther, C.; Bock, H.; Butenschön, F. Trimorphism of 2,2'-dipyridylamine: structures, phase transitions and thermodynamic stabilities Acta Crystallographica Section B, 1996, 52, 842-853 |
| 2101616 | CIF Paper | C6 H14 N4 O6 | P 1 21/c 1 | 5.637; 8.243; 12.258 90; 96.8; 90 | 565.6 | Videnova-Adrabińska, V. Symmetry constraints, molecular recognition and crystal engineering. Comparative structural studies of urea‒butanedioic and urea‒<i>E</i>-butanedioic acid (2:1) cocrystals Acta Crystallographica Section B, 1996, 52, 1048-1056 |
| 2101617 | CIF Paper | C6 H12 N4 O6 | P 1 21/c 1 | 5.54; 8.227; 12.426 90; 97.22; 90 | 561.86 | Videnova-Adrabińska, V. Symmetry constraints, molecular recognition and crystal engineering. Comparative structural studies of urea‒butanedioic and urea‒<i>E</i>-butanedioic acid (2:1) cocrystals Acta Crystallographica Section B, 1996, 52, 1048-1056 |
| 2101618 | CIF Paper | Cl2 H6 N2 Pd | P 1 | 6.3121; 6.4984; 3.3886 96.604; 97.29; 104.691 | 131.786 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S.; Blokhina, M. L. Structures and isomerization in diamminedichloropalladium(II) Acta Crystallographica Section B, 1996, 52, 909-916 |
| 2101619 | CIF Paper | Cl2 H6 N2 Pd | P -1 | 6.5398; 6.8571; 6.3573 103.311; 102.454; 100.609 | 262.58 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S.; Blokhina, M. L. Structures and isomerization in diamminedichloropalladium(II) Acta Crystallographica Section B, 1996, 52, 909-916 |
| 2101620 | CIF Paper | Cl2 H6 N2 Pd | P b c a | 8.154; 8.1482; 7.7945 90; 90; 90 | 517.87 | Kirik, S. D.; Solovyov, L. A.; Blokhin, A. I.; Yakimov, I. S.; Blokhina, M. L. Structures and isomerization in diamminedichloropalladium(II) Acta Crystallographica Section B, 1996, 52, 909-916 |
| 2101621 | CIF Paper | Mo O5 U | P b a a | 12.746; 7.3494; 4.1252 90; 90; 90 | 386.43 | D'yachenko, O. G.; Tabachenko, V. V.; Tali, R.; Kovba, L. M.; Marinder, B.-O.; Sundberg, M. Structure of UMoO~5~ studied by single-crystal X-ray diffraction and high-resolution transmission electron microscopy Acta Crystallographica Section B, 1996, 52, 961-965 |
| 2101622 | CIF Paper | Nb2.11 O14 Sb3.89 Ti | A 1 2/a 1 | 5.519; 4.865; 40.256 90; 91.02; 90 | 1080.7 | Ling, C. D.; Schmid, S.; Thompson, J. G.; Withers, R. L.; Sterns, M. Synthesis and structure refinement of a new type of layered intergrowth phase: Sb~3+<i>x~</i>Nb~3{-~<i>x</i>}TiO~14~ and Sb~3+<i>x~</i>Ta~3{-~<i>x</i>}TiO~14~ Acta Crystallographica Section B, 1996, 52, 932-938 |
| 2101623 | CIF Paper | O14 Sb4.26 Ta1.74 Ti | A 1 2/a 1 | 5.492; 4.837; 40.165 90; 91.08; 90 | 1066.79 | Ling, C. D.; Schmid, S.; Thompson, J. G.; Withers, R. L.; Sterns, M. Synthesis and structure refinement of a new type of layered intergrowth phase: Sb~3+<i>x~</i>Nb~3{-~<i>x</i>}TiO~14~ and Sb~3+<i>x~</i>Ta~3{-~<i>x</i>}TiO~14~ Acta Crystallographica Section B, 1996, 52, 932-938 |
| 2101624 | CIF Paper | C11 H32 N8 O3 S3 | P -1 | 10.3; 14.704; 15.784 75.3; 86.98; 72.25 | 2201.4 | Li, Q.; Mak, T. C. W. Inclusion compounds of thiourea and peralkylated ammonium salts. III. Hydrogen-bonded host lattices built of thiourea and nitrate ions Acta Crystallographica Section B, 1996, 52, 989-998 |
| 2101625 | CIF Paper | C15 H42 N8 O4 S3 | P 1 21/n 1 | 8.433; 9.369; 34.361 90; 91.01; 90 | 2714.4 | Li, Q.; Mak, T. C. W. Inclusion compounds of thiourea and peralkylated ammonium salts. III. Hydrogen-bonded host lattices built of thiourea and nitrate ions Acta Crystallographica Section B, 1996, 52, 989-998 |
| 2101626 | CIF Paper | C5 H16 N4 O3 S | P n m a | 15.72; 8.218; 8.709 90; 90; 90 | 1125.1 | Li, Q.; Mak, T. C. W. Inclusion compounds of thiourea and peralkylated ammonium salts. III. Hydrogen-bonded host lattices built of thiourea and nitrate ions Acta Crystallographica Section B, 1996, 52, 989-998 |
| 2101627 | CIF Paper | C13 H32 N4 O3 S | P 1 21/n 1 | 8.784; 14.421; 15.078 90; 92.31; 90 | 1908.4 | Li, Q.; Mak, T. C. W. Inclusion compounds of thiourea and peralkylated ammonium salts. III. Hydrogen-bonded host lattices built of thiourea and nitrate ions Acta Crystallographica Section B, 1996, 52, 989-998 |
| 2101628 | CIF Paper | C17 H40 N4 O3 S | P n a 21 | 19.934; 12.68; 9.092 90; 90; 90 | 2298.1 | Li, Q.; Mak, T. C. W. Inclusion compounds of thiourea and peralkylated ammonium salts. III. Hydrogen-bonded host lattices built of thiourea and nitrate ions Acta Crystallographica Section B, 1996, 52, 989-998 |
| 2101629 | CIF Paper | In3 O8 P2 | I -4 3 d | 11.152; 11.152; 11.152 90; 90; 90 | 1386.9 | Peltier, V.; L'Haridon, P.; Marchand, R.; Laurent, Y. Synthèse et caractérisation structurale d'un phosphate d'indium In~3~P~2~O~8~ présentant des paires In‒In Acta Crystallographica Section B, 1996, 52, 905-908 |
| 2101630 | CIF Paper | C6 H5 O3 P Pb | P -1 | 13.6907; 9.3327; 7.0432 106.188; 94.927; 96.977 | 851.04 | Cabeza, A.; Aranda, M. A. G.; Martinez-Lara, M.; Bruque, S.; Sanz, J. <i>Ab initio</i> powder structure determination and thermal behavior of a new lead(II) phenylphosphonate, Pb(O~3~PC~6~H~5~) Acta Crystallographica Section B, 1996, 52, 982-988 |
| 2101631 | CIF HKL Paper | C21 H21 N O | P b c a | 31.863; 11.088; 9.4 90; 90; 90 | 3321 | Jones, R.; Rattray, A. G. M.; Rettig, S. J.; Scheffer, J. R.; Trotter, J. Structures and photochemistry of dibenzobarrelene monoamides Acta Crystallographica Section B, 1996, 52, 1007-1013 |
| 2101632 | CIF HKL Paper | C23 H25 N O | P 1 21/c 1 | 10.846; 10.788; 17.0463 90; 107.836; 90 | 1898.7 | Jones, R.; Rattray, A. G. M.; Rettig, S. J.; Scheffer, J. R.; Trotter, J. Structures and photochemistry of dibenzobarrelene monoamides Acta Crystallographica Section B, 1996, 52, 1007-1013 |
| 2101633 | CIF HKL Paper | C32.75 H28.25 Cl0.75 N O | P 1 21/a 1 | 10.228; 32.818; 15.529 90; 99.79; 90 | 5136.6 | Jones, R.; Rattray, A. G. M.; Rettig, S. J.; Scheffer, J. R.; Trotter, J. Structures and photochemistry of dibenzobarrelene monoamides Acta Crystallographica Section B, 1996, 52, 1007-1013 |
| 2101634 | CIF Paper | C10 H19 N3 O4 | P 21 21 2 | 16.419; 15.309; 4.708 90; 90; 90 | 1183.4 | Görbitz, C. H.; Backe, P. H. Structures of <small>L</small>-valyl-<small>L</small>-glutamine and <small>L</small>-glutamyl-<small>L</small>-valine Acta Crystallographica Section B, 1996, 52, 999-1006 |
| 2101635 | CIF Paper | C10 H18 N2 O5 | P 1 21 1 | 6.487; 5.505; 16.741 90; 97.22; 90 | 593.1 | Görbitz, C. H.; Backe, P. H. Structures of <small>L</small>-valyl-<small>L</small>-glutamine and <small>L</small>-glutamyl-<small>L</small>-valine Acta Crystallographica Section B, 1996, 52, 999-1006 |
| 2101636 | CIF Paper | Cu S2 | P 1 21 1 | 5.709; 5.707; 5.708 90; 90.01; 90 | 186 | Marcos, C.; Paniagua, A.; Moreiras, D. B.; García-Granda, S.; Díaz, M. R. Villamaninite, a case of noncubic pyrite-type structure Acta Crystallographica Section B, 1996, 52, 899-904 |
| 2101637 | CIF Paper | Cu S2 | P 1 21 1 | 5.704; 5.703; 5.704 90; 89.99; 90 | 185.5 | Marcos, C.; Paniagua, A.; Moreiras, D. B.; García-Granda, S.; Díaz, M. R. Villamaninite, a case of noncubic pyrite-type structure Acta Crystallographica Section B, 1996, 52, 899-904 |
| 2101638 | CIF Paper | C14 H26 N4 O4 | P 1 21 1 | 5.9078; 24.542; 5.9151 90; 102.039; 90 | 838.76 | Bussien Gaillard, V.; Paciorek, W.; Schenk, K.; Chapuis, G. Hexamethylenetetramine suberate, a strongly anharmonic modulated structure Acta Crystallographica Section B, 1996, 52, 1036-1047 |
| 2101639 | CIF Paper | C14 H26 N4 O4 | P 1 21 1 | 5.835; 24.202; 5.813 90; 101.59; 90 | 804.2 | Bussien Gaillard, V.; Paciorek, W.; Schenk, K.; Chapuis, G. Hexamethylenetetramine suberate, a strongly anharmonic modulated structure Acta Crystallographica Section B, 1996, 52, 1036-1047 |
| 2101640 | CIF Paper | C4 H8 Co O8 | C 1 2/c 1 | 8.9667; 13.356; 6.7119 90; 99.412; 90 | 793 | Lee, Chi-Rung; Wang, Chih-Chieh; Wang, Yu Structural relationship of various squarates Acta Crystallographica Section B, 1996, 52, 966-975 |
| 2101641 | CIF Paper | C4 H8 Ni O8 | C 1 2/c 1 | 8.9315; 13.246; 6.6893 90; 99.43; 90 | 780.7 | Lee, Chi-Rung; Wang, Chih-Chieh; Wang, Yu Structural relationship of various squarates Acta Crystallographica Section B, 1996, 52, 966-975 |
| 2101642 | CIF Paper | C8 H10 Mn O12 | P -1 | 5.194; 7.454; 8.9007 67.07; 77.26; 74.46 | 303.1 | Lee, Chi-Rung; Wang, Chih-Chieh; Wang, Yu Structural relationship of various squarates Acta Crystallographica Section B, 1996, 52, 966-975 |
| 2101643 | CIF Paper | C8 H10 Fe O12 | P -1 | 5.1577; 7.4107; 8.7823 66.846; 77.109; 74.748 | 295.05 | Lee, Chi-Rung; Wang, Chih-Chieh; Wang, Yu Structural relationship of various squarates Acta Crystallographica Section B, 1996, 52, 966-975 |
| 2101644 | CIF Paper | C4 H4 Fe O6 | R -3 :H | 11.4395; 11.4395; 14.504 90; 90; 120 | 1643.7 | Lee, Chi-Rung; Wang, Chih-Chieh; Wang, Yu Structural relationship of various squarates Acta Crystallographica Section B, 1996, 52, 966-975 |
| 2101645 | CIF Paper | C4 H4.67 Co O6.33 | P n -3 n :2 | 16.255; 16.255; 16.255 90; 90; 90 | 4295 | Lee, Chi-Rung; Wang, Chih-Chieh; Wang, Yu Structural relationship of various squarates Acta Crystallographica Section B, 1996, 52, 966-975 |
| 2101646 | CIF Paper | C4 H13.12 K0.72 N0.28 Na O10 | P 21 21 2 | 11.899; 14.273; 6.211 90; 90; 90 | 1054.8 | Suzuki, E.; Kabasawa, H.; Honma, T.; Nozaki, R.; Shiozaki, Y. Temperature dependence of crystal structure of NaK~0.72~(NH~4~)~0.28~(+)-C~4~H~4~O~6~.4H~2~O in the paraelectric phase Acta Crystallographica Section B, 1996, 52, 976-981 |
| 2101647 | CIF Paper | C4 H13.12 K0.72 N0.28 Na O10 | P 21 21 2 | 11.929; 14.297; 6.221 90; 90; 90 | 1061 | Suzuki, E.; Kabasawa, H.; Honma, T.; Nozaki, R.; Shiozaki, Y. Temperature dependence of crystal structure of NaK~0.72~(NH~4~)~0.28~(+)-C~4~H~4~O~6~.4H~2~O in the paraelectric phase Acta Crystallographica Section B, 1996, 52, 976-981 |
| 2101648 | CIF Paper | C4 H13.12 K0.72 N0.28 Na O10 | P 21 21 2 | 11.955; 14.317; 6.231 90; 90; 90 | 1066.5 | Suzuki, E.; Kabasawa, H.; Honma, T.; Nozaki, R.; Shiozaki, Y. Temperature dependence of crystal structure of NaK~0.72~(NH~4~)~0.28~(+)-C~4~H~4~O~6~.4H~2~O in the paraelectric phase Acta Crystallographica Section B, 1996, 52, 976-981 |
| 2101649 | CIF Paper | Nb7 O56 W12.5 Zr0.5 | P 1 m 1 | 19; 3.9; 13.8 90; 93.5; 90 | 1020.67 | Krumeich, F.; Liedtke, G.; Mader, W. A novel intergrowth structure between ReO~3~-type and tetragonal tungsten bronze-type in the Zr/Nb/W/O system Acta Crystallographica Section B, 1996, 52, 917-922 |
| 2101650 | CIF Paper | C5 H9 N O | P 1 21/c 1 | 6.221; 12.076; 7.529 90; 111.03; 90 | 527.9 | Müller, G.; Lutz, M.; Harder, S. Methyl group conformation-determining intermolecular C‒H···O hydrogen bonds: structure of <i>N</i>-methyl-2-pyrrolidone Acta Crystallographica Section B, 1996, 52, 1014-1022 |
| 2101651 | CIF Paper | D12 N6 Ni O4 | C 1 2/m 1 | 10.609; 6.773; 5.879 90; 114.86; 90 | 383.3 | Iversen, B. B.; Larsen, F. K.; Figgis, B. N.; Reynolds, P. A.; Schultz, A. J. Atomic displacement parameters for Ni(ND~3~)~4~(NO~2~)~2~ from 9 K X-ray and 13 K time-of-flight neutron diffraction data Acta Crystallographica Section B, 1996, 52, 923-931 |
| 2101652 | CIF Paper | D12 N6 Ni O4 | C 1 2/m 1 | 10.609; 6.773; 5.879 90; 114.86; 90 | 383.3 | Iversen, B. B.; Larsen, F. K.; Figgis, B. N.; Reynolds, P. A.; Schultz, A. J. Atomic displacement parameters for Ni(ND~3~)~4~(NO~2~)~2~ from 9 K X-ray and 13 K time-of-flight neutron diffraction data Acta Crystallographica Section B, 1996, 52, 923-931 |
| 2101653 | CIF Paper | C7 Br D16 N O2 | P 1 21/n 1 | 10.951; 13.396; 7.072 90; 108.88; 90 | 981.6 | Shankland, N.; Florence, A. J.; Wilson, C. C. Single-Crystal Neutron Diffraction Analysis of Anion–Cation Interactions in Perdeuteroacetylcholine Bromide at 100 K Acta Crystallographica Section B, 1997, 53, 176-180 |
| 2101654 | CIF Paper | O3 Pb Zr | P b a m | 5.884; 11.787; 8.231 90; 90; 90 | 570.9 | Corker, D. L.; Glazer, A. M.; Dec, J.; Roleder, K.; Whatmore, R. W. A Re-investigation of the Crystal Structure of the Perovskite PbZrO~3~ by X-ray and Neutron Diffraction Acta Crystallographica Section B, 1997, 53, 135-142 |
| 2101655 | CIF Paper | O3 Pb Zr | P b a m | 5.8878; 11.789; 8.2527 90; 90; 90 | 572.83 | Corker, D. L.; Glazer, A. M.; Dec, J.; Roleder, K.; Whatmore, R. W. A Re-investigation of the Crystal Structure of the Perovskite PbZrO~3~ by X-ray and Neutron Diffraction Acta Crystallographica Section B, 1997, 53, 135-142 |
| 2101656 | CIF Paper | D4 N O4 Re | I 41/a :2 | 5.99986; 5.99986; 12.3976 90; 90; 90 | 446.29 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101657 | CIF Paper | D4 N O4 Re | I 41/a :2 | 6.00092; 6.00092; 12.3989 90; 90; 90 | 446.5 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101658 | CIF Paper | D4 N O4 Re | I 41/a :2 | 6.00193; 6.00193; 12.4027 90; 90; 90 | 446.78 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101659 | CIF Paper | D4 N O4 Re | I 41/a :2 | 6.00313; 6.00313; 12.4118 90; 90; 90 | 447.29 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101660 | CIF Paper | D4 N O4 Re | I 41/a :2 | 6.00301; 6.00301; 12.4258 90; 90; 90 | 447.78 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101661 | CIF Paper | D4 N O4 Re | I 41/a :2 | 6.00091; 6.00091; 12.4466 90; 90; 90 | 448.21 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101662 | CIF Paper | D4 N O4 Re | I 41/a :2 | 5.9956; 5.9956; 12.4783 90; 90; 90 | 448.56 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101663 | CIF Paper | D4 N O4 Re | I 41/a :2 | 5.98872; 5.98872; 12.466 90; 90; 90 | 447.09 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101664 | CIF Paper | D4 N O4 Re | I 41/a :2 | 5.97765; 5.97765; 12.516 90; 90; 90 | 447.225 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101665 | CIF Paper | D4 N O4 Re | I 41/a :2 | 5.95898; 5.95898; 12.5916 90; 90; 90 | 447.12 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101666 | CIF Paper | D4 N O4 Re | I 41/a :2 | 5.9324; 5.9324; 12.6897 90; 90; 90 | 446.59 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101667 | CIF Paper | D4 N O4 Re | I 41/a :2 | 5.91124; 5.91124; 12.7765 90; 90; 90 | 446.45 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101668 | CIF Paper | D4 N O4 Re | I 41/a :2 | 5.89725; 5.89725; 12.8464 90; 90; 90 | 446.77 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101669 | CIF Paper | D4 N O4 Re | I 41/a :2 | 5.8805; 5.8805; 12.9874 90; 90; 90 | 449.11 | I.P.Swainson; R.J.C.Brown Refinement of Ammonium Perrhenate Structure Using a Pseudo-Spin Model for the Ammonium Ion Orientation Acta Crystallographica Section B, 1997, 53, 76-81 |
| 2101670 | CIF Paper | C12 H28 F12 N2 P2 | P 1 21/c 1 | 6.282; 13.252; 13.112 90; 98.08; 90 | 1080.7 | McCormack, Kirsty L.; Mallinson, Paul R.; Webster, Brian C.; Yufit, Dmitrii S. Experimental and Theoretical Studies of Charge Density Distribution in <i>E</i>-Tetraethyl-1,4-diammoniumbut-2-ene.2PF~6~ Acta Crystallographica Section B, 1997, 53, 181-187 |
| 2101671 | CIF Paper | Al2 O5 Si | P n n m | 7.7992; 7.905; 5.5591 90; 90; 90 | 342.73 | Pilati, T.; Demartin, F.; Gramaccioli, C. M. Transferability of Empirical Force Fields in Silicates: Lattice-Dynamical Evaluation of Atomic Displacement Parameters and Thermodynamic Properties for the Al~2~OSiO~4~ Polymorphs Acta Crystallographica Section B, 1997, 53, 82-94 |
| 2101672 | CIF Paper | Ag2 P2 S11 Ti2 | P n m a | 8.5222; 6.8359; 24.142 90; 90; 90 | 1406.4 | Gaudin, E.; Fischer, L.; Boucher, F.; Evain, M.; Petricek, V. Ag~2~Ti~2~P~2~S~11~: A New Layered Thiophosphate. Synthesis, Structure Determination and Temperature Dependence of the Silver Distribution Acta Crystallographica Section B, 1997, 53, 67-75 |
| 2101673 | CIF Paper | H4 Na3 Nd O17 Si6 | C m m 2 | 7.385; 30.831; 7.1168 90; 90; 90 | 1620.4 | Haile, S. M.; Wuensch, B. J.; Laudise, R. A.; Maier, J. Structure of Na~3~NdSi~6~O~15~.2H~2~O ‒ a Layered Silicate with Paths for Possible Fast-Ion Conduction Acta Crystallographica Section B, 1997, 53, 7-17 |
| 2101674 | CIF Paper | O4 W Zn | P 1 2/c 1 | 4.69263; 5.72129; 4.92805 90; 90.6321; 90 | 132.3 | Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B, 1997, 53, 102-112 |
| 2101675 | CIF Paper | Cu0.1 O4 W Zn0.9 | P 1 2/c 1 | 4.69114; 5.72608; 4.92536 90; 90.7507; 90 | 132.293 | Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B, 1997, 53, 102-112 |
| 2101676 | CIF Paper | Cu0.15 O4 W Zn0.85 | P 1 2/c 1 | 4.68766; 5.72752; 4.92052 90; 90.8566; 90 | 132.095 | Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B, 1997, 53, 102-112 |
| 2101677 | CIF Paper | Cu0.2 O4 W Zn0.8 | P 1 2/c 1 | 4.68502; 5.73194; 4.9156 90; 91.0026; 90 | 131.985 | Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B, 1997, 53, 102-112 |
| 2101678 | CIF Paper | Cu0.25 O4 W Zn0.75 | P -1 | 4.68499; 5.73796; 4.91163 89.766; 91.135; 91.467 | 131.966 | Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B, 1997, 53, 102-112 |
| 2101679 | CIF Paper | Cu0.3 O4 W Zn0.7 | P -1 | 4.68411; 5.74374; 4.90925 89.6303; 91.1899; 92.073 | 131.963 | Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B, 1997, 53, 102-112 |
| 2101680 | CIF Paper | Cu0.35 O4 W Zn0.65 | P -1 | 4.6901; 5.76474; 4.90647 89.3597; 91.3394; 93.2364 | 132.403 | Schofield, P. F.; Knight, K. S.; Redfern, S. A. T.; Cressey, G. Distortion Characteristics Across the Structural Phase Transition in (Cu~1{-~<i>x</i>}Zn~<i>x~</i>)WO~4~ Acta Crystallographica Section B, 1997, 53, 102-112 |
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