Crystallography Open Database
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Searching volume of publication is 48
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1000100 | CIF | F12 Fe2 H6 Mn O3 Pb2 | P -6 2 m | 9.32; 9.32; 3.9618 90; 90; 120 | 298 | Le Bail, A; Mercier, A M Structure of Pb~2~MnFe~2~F~12~(H~2~O)~2~ Acta Crystallographica C (39,1983-), 1992, 48, 239-241 |
| 1001236 | CIF | K4 Mo8 O52 P12 | C 1 2/c 1 | 10.7433; 14.0839; 8.8519 90; 126.42; 90 | 1077.8 | Leclaire, A; Monier, J C; Raveau, B K~4~ Mo~8~ P~12~ O~52~, A Tunnel Structure Characterized by an Unusual Valence of Molybdenum Journal of Solid State Chemistry, 1983, 48, 147-153 |
| 1001534 | CIF | O10 P2 Pb V2 | P 1 21/c 1 | 5.2306; 8.5805; 16.79 90; 91.01; 90 | 753.4 | Grandin, A; Chardon, J; Borel, M M; Leclaire, A; Raveau, B Structure of PbV~2~P~2~O~1~0 Acta Crystallographica C (39,1983-), 1992, 48, 1913-1915 |
| 1001535 | CIF | Ba0.84 Nb8 O34 P5 Rb3 | P -4 m 2 | 10.6604; 10.6604; 6.4434 90; 90; 90 | 732.3 | Gueho, C; Borel, M M; Grandin, A; Leclaire, A; Raveau, B Structure of Ba~0.84~Rb~3~Nb~8~P~5~O~34~ Acta Crystallographica C (39,1983-), 1992, 48, 2066-2067 |
| 1001537 | CIF | O4 Sr Tl2 | P n a m | 10.0451; 11.6905; 3.4086 90; 90; 90 | 400.3 | Michel, C; Hervieu, M; Caignaert, V; Raveau, B Structure Refinement of the semi-Metallic Oxide SrTl~2~O~4~: a Neutron Diffraction Study Acta Crystallographica C (39,1983-), 1992, 48, 1747-1749 |
| 1001541 | CIF | K4 Nb8 O34 P4 Si | P -4 m 2 | 10.605; 10.605; 6.4099 90; 90; 90 | 720.9 | Leclaire, A; Borel, M M; Chardon, J; Grandin, A; Raveau, B A niobium silicophosphate belonging to the niobium phosphate bronzeseries: K~4~Nb~8~P~4~SiO~34~ Acta Crystallographica C (39,1983-), 1992, 48, 1744-1747 |
| 1001691 | CIF | Bi1.916 Cu O5.482 Sr1.84 | A 1 2/a 1 | 5.3791; 5.3811; 24.58899 90; 89.93; 90 | 711.7 | Leligny, H; Durcok, S; Labbe, P; Ledesert, M; Raveau, B X-ray investigation of the incommensurate modulated structure of Bi2.08 Sr1.84 Cu O6-d Acta Crystallographica B (39,1983-), 1992, 48, 407-418 |
| 1005005 | CIF | Li7 N4 Nb | P a -3 | 9.829; 9.829; 9.829 90; 90; 90 | 949.6 | Vennos, D A; DiSalvo, F J Structure of lithium niobium nitride Acta Crystallographica C (39,1983-), 1992, 48, 610-612 |
| 1007199 | CIF | Ba3 H16 O26 P6 | C 1 2/c 1 | 20.98; 7.227; 17.44 90; 119.56; 90 | 2300.1 | Rzaigui, M; Averbuch-Pouchot, M; Durif, A Crystal chemistry of cyclo-hexaphosphates. XIX. Structure of barium cyclo-hexaphosphate octahydrate Acta Crystallographica C (39,1983-), 1992, 48, 241-243 |
| 1007200 | CIF | Ag9 H8 N2 Na O34 P8 | C m c m | 17.254; 7.543; 23.465 90; 90; 90 | 3053.9 | Averbuch-Pouchot, M T; Durif, A Structure of nonasilver sodium cyclooctaphosphate dinitrate tetrahydrate: Ag~9~NaP~8~O~24~(NO~3~)~2~ . 4H~2~O Acta Crystallographica C (39,1983-), 1992, 48, 1173-1176 |
| 1007225 | CIF | H13 N2 O10 P2 Te0.5 | P 1 21/n 1 | 7.651; 21.78999; 6.689 90; 113.85; 90 | 1019.9 | Averbuch-Pouchot, M. T.; Durif, A. Structure of an adduct between diammonium dihydrogendiphoshate and telluric acid: (NH~4~)~2~H~2~P~2~O~7~ . Te(OH)~6~ Acta Crystallographica, Section C: Crystal Structure Communications, 1992, 48, 973-975 |
| 1008190 | CIF | H2 Li2 O5 S | P 1 21 1 | 5.4537; 4.857; 8.1734 90; 107.367; 90 | 206.6 | Smith, H G; Peterson, S W; Levy, H A Neutron-diffraction study of lithium sulfate monohydrate Journal of Chemical Physics, 1968, 48, 5561-5565 |
| 1008204 | CIF | I Sb Se | P n m a | 8.698; 4.127; 10.412 90; 90; 90 | 373.8 | Ibanez, A; Jumas, J C; Olivier-Fourcade, J; Philippot, E; Maurin, M Sur les Chalcogeno-iodures d'antimoine SbXI (X=S,Se,Te):Structures et spectroscopie Moessbauer de ^121^Sb Journal of Solid State Chemistry, 1983, 48, 272-283 |
| 1008205 | CIF | I Sb Te | P -1 | 7.57; 7.159; 4.228 107.22; 106.18; 77.19 | 207.8 | Ibanez, A; Jumas, J C; Olivier-Fourcade, J; Philippot, E; Maurin, M Sur les Chalcogeno-iodures d'antimoine SbXI (X=S,Se,Te):Structures et spectroscopie Moessbauer de ^121^Sb Journal of Solid State Chemistry, 1983, 48, 272-283 |
| 1008498 | CIF | Cu O6 Pt Sr3 | C 1 2/c 1 | 9.317; 9.72; 6.685 90; 91.95; 90 | 605.1 | Hodeau, J L; Tu, H Y; Bordet, P; Fournier, T; Strobel, P; Marezio, M; Chandrashekhar, G V Structure and twinning of Sr~3~CuPtO~6~ Acta Crystallographica B (39,1983-), 1992, 48, 1-11 |
| 1008577 | CIF | Cu O12 P3 Zr2 | R -3 c :H | 8.9018; 8.9018; 22.2021 90; 90; 120 | 1523.6 | Bussereau, I; Belkhiria, M S; Gravereau, P; Boireau, A; Soubeyroux, J L; Olazcuaga, R; Le Flem, G Structure of CuZr~2~(PO~4~)~3~ by X-ray and neutron powder diffraction Acta Crystallographica C (39,1983-), 1992, 48, 1741-1744 |
| 1008578 | CIF | Cu O12 P3 Zr2 | R -3 c :H | 8.892; 8.892; 22.19 90; 90; 120 | 1519.5 | Bussereau, I; Belkhiria, M S; Gravereau, P; Boireau, A; Soubeyroux, J L; Olazcuaga, R; Le Flem, G Structure of CuZr~2~(PO~4~)~3~ by X-ray and neutron powder diffraction Acta Crystallographica C (39,1983-), 1992, 48, 1741-1744 |
| 1008649 | CIF | Ba2 Cu3 O6.877 Y | P m m m | 3.8184; 3.8857; 11.701 90; 90; 90 | 173.6 | Sullivan, J D; Bordet, P; Marezio, M; Takenaka, K; Uchida, S Electron-density Fourier maps of an untwinned YBa~2~Cu~3~O~6.877~ single crystal by x-ray-diffraction data Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1993, 48, 10638-10641 |
| 1008788 | CIF | Cu3 Fe Nd O12 Ti3 | I m -3 | 7.436; 7.436; 7.436 90; 90; 90 | 411.2 | Meyer, G; Gros, Y; Bochu, B; Collomb, A; Chenavas, J; Joubert, J C; Marezio, M Synthesis, crystal structure, and Moessbauer study of a series of perovskite-like compounds (A Cu3) (M, Fe)4 O12 Physica Status Solidi, Sectio A: Applied Research, 1978, 48, 581-586 |
| 1010318 | CIF | Cu Fe S2 | P -4 2 m | 5.27; 5.27; 5.194 90; 90; 90 | 144.3 | Gross, R; Gross, N Die Atomanordnung des Kupferkieses und die Struktur der Beruehrungsflaechen gesetzmaessig verwachsener Kristalle Neues Jahrbuch fuer Mineralogie, Geologie und Palaeontologie. Beilage (- 1925), 1923, 48, 113-135 |
| 1010624 | CIF | I Na O4 | I 41/a :1 | 5.322; 5.322; 11.93 90; 90; 90 | 337.9 | Kirkpatrick, L M; Dickinson, R G The crystal structure of sodium periodate Journal of the American Chemical Society, 1927, 48, 2327-2334 |
| 1010634 | CIF | Cu3 S4 V | P -4 3 m | 5.379; 5.379; 5.379 90; 90; 90 | 155.6 | Lundqvist, D; Westgren, A The crystal structure of Cu V S~4~ Svensk Kemisk Tidskrift, 1936, 48, 241-243 |
| 1010826 | CIF | Be3 Ca Mn2 O12 Si3 | 7.6; 16.11; 27.9 90; 90; 90 | 3416 | Aminoff, G Zur Kristallographie des Trimerits. Ein Beitrag zur Kenntnis der Pseudosymmetrie. Geologiska Foereningens i Stockholm Foerhandlingar, 1926, 48, 19-43 | |
| 1010891 | CIF | Mn5 Si3 | P 63/m c m | 6.898; 6.898; 4.802 90; 90; 120 | 197.9 | Amark, K.; Boren, B.; Westgren, A. On the crystal structure of Mn~5~Si~3~ Svensk Kemisk Tidskrift, 1936, 48, 273-276 |
| 1011076 | CIF | Cl2 Hg2 | I 4/m m m | 4.47; 4.47; 10.89 90; 90; 90 | 217.6 | Havighurst, R J Parameters in crystal structure. The mercurous halides Journal of the American Chemical Society, 1926, 48, 2113-2130 |
| 1011077 | CIF | Br2 Hg2 | P 42/m n m | 4.66; 4.66; 11.12 90; 90; 90 | 241.5 | Havighurst, R J Parameters in crystal structure. The mercurouos halides Journal of the American Chemical Society, 1926, 48, 2113-2131 |
| 1011078 | CIF | Hg2 I2 | P 42/m n m | 4.92; 4.92; 11.61 90; 90; 90 | 281 | Havighurst, R J Parameters in crystal structure. The mercurous halides Journal of the American Chemical Society, 1926, 48, 2113-2125 |
| 1011098 | CIF | Te | P 31 2 1 | 4.454; 4.454; 5.924 90; 90; 120 | 101.8 | Bradley, A J The crystal structure of tellurium Philosophical Magazine, Serie 6 (1901-1925), 1924, 48, 477-496 |
| 1011206 | CIF | Co9 S8 | F m -3 m | 9.927; 9.927; 9.927 90; 90; 90 | 978.3 | Lindqvist, M; Lindqvist, D; Westgren, A The crystal structure of Co9 S8 and of pentlandite (Ni Fe)9 S8 Svensk Kemisk Tidskrift, 1936, 48, 156-160 |
| 1011207 | CIF | Fe9 Ni9 S16 | F m -3 m | 10.09; 10.09; 10.09 90; 90; 90 | 1027.2 | Lindqvist, M; Lindqvist, D; Westgren, A The crystal structure of Co9 S8 and of pentlandite (Ni Fe)9 S8 Svensk Kemisk Tidskrift, 1936, 48, 156-160 |
| 1011208 | CIF | Fe6 Ni3 S8 | F m -3 m | 9.91; 9.91; 9.91 90; 90; 90 | 973.2 | Lindqvist, M; Lindqvist, D; Westgren, A The crystal structure of Co9 S8 and of pentlandite (Ni Fe)9 S8 Svensk Kemisk Tidskrift, 1936, 48, 156-160 |
| 1501647 | CIF | C84 H81 Br4 N3 P6 Re3 S4 | C 1 2/c 1 | 44.6606; 13.7072; 29.2555 90; 98.463; 90 | 17714.4 | Sergey Konchenko; Rosa Llusar; Pavel Petrov; Aleksandr Virovets; Artem Bogomyakov; Carlos Gomez Garcia; Victor Polo Synthesis, molecular and electronic structure of an incomplete cuboidal Re3S4 cluster with an unusual quadruplet ground state Che. Commun., 2012, 48, 2713 |
| 1501648 | CIF | C82.5 H81 Br2.6 Cl10.4 P6 Re3 S4 | P -1 | 13.6395; 15.3991; 22.8431 80.532; 72.639; 83.432 | 4506.04 | Sergey Konchenko; Rosa Llusar; Pavel Petrov; Aleksandr Virovets; Artem Bogomyakov; Carlos Gomez Garcia; Victor Polo Synthesis, molecular and electronic structure of an incomplete cuboidal Re3S4 cluster with an unusual quadruplet ground state Che. Commun., 2012, 48, 2713 |
| 1506344 | CIF | C19 H29 N O5 | P 1 21 1 | 6.866; 19.559; 7.04 90; 97.132; 90 | 938.1 | Simoni, Daniele; Rossi, Marcello; Bertolasi, Valerio; Roberti, Marinella; Pizzirani, Daniela; Rondanin, Riccardo; Baruchello, Riccardo; Invidiata, Francesco Paolo; Tolomeo, Manlio; Grimaudo, Stefania; Merighi, Stefania; Varani, Katia; Gessi, Stefania; Borea, Pier Andrea; Marino, Silvia; Cavallini, Sabrina; Bianchi, Clementina; Siniscalchi, Anna Synthesis and pharmacology of 6-substituted benztropines: discovery of novel dopamine uptake inhibitors possessing low binding affinity to the dopamine transporter. Journal of medicinal chemistry, 2005, 48, 3337-3343 |
| 1506345 | CIF | C30 H32 Cl3 N8 O2 Ru | C 1 c 1 | 17.681; 11.082; 16.738 90; 102.46; 90 | 3202.4 | Jakupec, Michael A.; Reisner, Erwin; Eichinger, Anna; Pongratz, Martina; Arion, Vladimir B.; Galanski, Markus; Hartinger, Christian G.; Keppler, Bernhard K. Redox-active antineoplastic ruthenium complexes with indazole: correlation of in vitro potency and reduction potential. Journal of medicinal chemistry, 2005, 48, 2831-2837 |
| 1506346 | CIF | C34 H36 Cl2 N8 O2 Ru | P -1 | 10.891; 13.279; 14.399 65.66; 69.04; 68.36 | 1710.8 | Jakupec, Michael A.; Reisner, Erwin; Eichinger, Anna; Pongratz, Martina; Arion, Vladimir B.; Galanski, Markus; Hartinger, Christian G.; Keppler, Bernhard K. Redox-active antineoplastic ruthenium complexes with indazole: correlation of in vitro potency and reduction potential. Journal of medicinal chemistry, 2005, 48, 2831-2837 |
| 1506347 | CIF | C21 H28 O3 | P 21 21 21 | 10.405; 16.508; 20.85 90; 90; 90 | 3581.3 | Veleiro, Adriana S.; Pecci, Adali; Monteserín, María C; Baggio, Ricardo; Garland, María T; Lantos, Carlos P.; Burton, Gerardo 6,19-Sulfur-bridged progesterone analogues with antiimmunosuppressive activity. Journal of medicinal chemistry, 2005, 48, 5675-5683 |
| 1506348 | CIF | C21 H28 O2 S | P 21 21 21 | 11.153; 12.65; 12.94 90; 90; 90 | 1825.6 | Veleiro, Adriana S.; Pecci, Adali; Monteserín, María C; Baggio, Ricardo; Garland, María T; Lantos, Carlos P.; Burton, Gerardo 6,19-Sulfur-bridged progesterone analogues with antiimmunosuppressive activity. Journal of medicinal chemistry, 2005, 48, 5675-5683 |
| 1506349 | CIF | C14 H16 Cu Fe N10 O5 S | P 1 21/n 1 | 13.157; 13.641; 14.205 90; 115.98; 90 | 2291.8 | Belicchi-Ferrari, Marisa; Bisceglie, Franco; Casoli, Claudio; Durot, Stéphanie; Morgenstern-Badarau, Irène; Pelosi, Giorgio; Pilotti, Elisabetta; Pinelli, Silvana; Tarasconi, Pieralberto Copper(II) and cobalt(III) pyridoxal thiosemicarbazone complexes with nitroprusside as counterion: syntheses, electronic properties, and antileukemic activity. Journal of medicinal chemistry, 2005, 48, 1671-1675 |
| 1506350 | CIF | C23 H34 Cu2 Fe N14 O11 S2 | P 1 21/n 1 | 13.946; 7.163; 18.389 90; 93.37; 90 | 1833.8 | Belicchi-Ferrari, Marisa; Bisceglie, Franco; Casoli, Claudio; Durot, Stéphanie; Morgenstern-Badarau, Irène; Pelosi, Giorgio; Pilotti, Elisabetta; Pinelli, Silvana; Tarasconi, Pieralberto Copper(II) and cobalt(III) pyridoxal thiosemicarbazone complexes with nitroprusside as counterion: syntheses, electronic properties, and antileukemic activity. Journal of medicinal chemistry, 2005, 48, 1671-1675 |
| 1506351 | CIF | C41 H60 Co2 Fe N22 O17 S4 | P -1 | 15.278; 13.533; 7.977 84.4; 76.78; 77.22 | 1563.9 | Belicchi-Ferrari, Marisa; Bisceglie, Franco; Casoli, Claudio; Durot, Stéphanie; Morgenstern-Badarau, Irène; Pelosi, Giorgio; Pilotti, Elisabetta; Pinelli, Silvana; Tarasconi, Pieralberto Copper(II) and cobalt(III) pyridoxal thiosemicarbazone complexes with nitroprusside as counterion: syntheses, electronic properties, and antileukemic activity. Journal of medicinal chemistry, 2005, 48, 1671-1675 |
| 1506352 | CIF | C28 H38 N O6 P | P 1 | 6.413; 13.141; 17.092 82.02; 86.3; 76.29 | 1385.1 | Albert, Rainer; Hinterding, Klaus; Brinkmann, Volker; Guerini, Danilo; Müller-Hartwieg, Constanze; Knecht, Helmut; Simeon, Corinne; Streiff, Markus; Wagner, Trixie; Welzenbach, Karl; Zécri, Frédéric; Zollinger, Markus; Cooke, Nigel; Francotte, Eric Novel immunomodulator FTY720 is phosphorylated in rats and humans to form a single stereoisomer. Identification, chemical proof, and biological characterization of the biologically active species and its enantiomer. Journal of medicinal chemistry, 2005, 48, 5373-5377 |
| 1506353 | CIF | C23 H21 F4 N O4 | P -1 | 8.8822; 9.7444; 12.9675 76.306; 72.48; 89.873 | 1036.98 | Deng, Bo-Liang; Hartman, Tracy L.; Buckheit, Jr, Robert W; Pannecouque, Christophe; De Clercq, Erik; Fanwick, Phillip E.; Cushman, Mark Synthesis, anti-HIV activity, and metabolic stability of new alkenyldiarylmethane HIV-1 non-nucleoside reverse transcriptase inhibitors. Journal of medicinal chemistry, 2005, 48, 6140-6155 |
| 1506354 | CIF | C9 H8 I N O2 | P 1 21/c 1 | 4.1515; 16.0162; 14.1406 90; 97.411; 90 | 932.37 | Deng, Bo-Liang; Hartman, Tracy L.; Buckheit, Jr, Robert W; Pannecouque, Christophe; De Clercq, Erik; Fanwick, Phillip E.; Cushman, Mark Synthesis, anti-HIV activity, and metabolic stability of new alkenyldiarylmethane HIV-1 non-nucleoside reverse transcriptase inhibitors. Journal of medicinal chemistry, 2005, 48, 6140-6155 |
| 1506355 | CIF | C22 H32 Cl2 N2 O6 Pt | P 1 21/c 1 | 7.7485; 18.294; 18.356 90; 92.129; 90 | 2600.2 | Ang, Wee Han; Pilet, Sébastien; Scopelliti, Rosario; Bussy, François; Juillerat-Jeanneret, Lucienne; Dyson, Paul J. Synthesis and characterization of platinum(IV) anticancer drugs with functionalized aromatic carboxylate ligands: influence of the ligands on drug efficacies and uptake. Journal of medicinal chemistry, 2005, 48, 8060-8069 |
| 1506356 | CIF | C26 H36 Cl2 N2 O6 Pt | I 1 2/a 1 | 23.951; 7.8455; 32.732 90; 110.353; 90 | 5766.6 | Ang, Wee Han; Pilet, Sébastien; Scopelliti, Rosario; Bussy, François; Juillerat-Jeanneret, Lucienne; Dyson, Paul J. Synthesis and characterization of platinum(IV) anticancer drugs with functionalized aromatic carboxylate ligands: influence of the ligands on drug efficacies and uptake. Journal of medicinal chemistry, 2005, 48, 8060-8069 |
| 1506357 | CIF | C24 H30 Cl2 N4 O6 Pt | P -1 | 7.8196; 12.2969; 16.4366 81.492; 77.063; 88.498 | 1523.4 | Ang, Wee Han; Pilet, Sébastien; Scopelliti, Rosario; Bussy, François; Juillerat-Jeanneret, Lucienne; Dyson, Paul J. Synthesis and characterization of platinum(IV) anticancer drugs with functionalized aromatic carboxylate ligands: influence of the ligands on drug efficacies and uptake. Journal of medicinal chemistry, 2005, 48, 8060-8069 |
| 1506358 | CIF | C20 H24 Cl2 N2 O9 Pt | P -1 | 8.9038; 12.4327; 12.8543 62.59; 82.906; 72.039 | 1201.4 | Ang, Wee Han; Pilet, Sébastien; Scopelliti, Rosario; Bussy, François; Juillerat-Jeanneret, Lucienne; Dyson, Paul J. Synthesis and characterization of platinum(IV) anticancer drugs with functionalized aromatic carboxylate ligands: influence of the ligands on drug efficacies and uptake. Journal of medicinal chemistry, 2005, 48, 8060-8069 |
| 1506359 | CIF | C57 H58 N2 O22 | P 31 | 15.6681; 15.6681; 17.4559 90; 90; 120 | 3711.12 | Post, Glen C.; Barthel, Benjamin L.; Burkhart, David J.; Hagadorn, John R.; Koch, Tad H. Doxazolidine, a proposed active metabolite of doxorubicin that cross-links DNA. Journal of medicinal chemistry, 2005, 48, 7648-7657 |
| 1509028 | CIF | Ag0.7 In0.3 | P 63/m m c | 2.961; 2.961; 4.778 90; 90; 120 | 36.279 | Ferguson, R.B.; Wagemann, R.; Campbell, A.N. The silver-indium system: Thermal analysis, photomicrography, electron microprobe, and X-ray powder diffraction results Canadian Journal of Chemistry, 1970, 48, 1703-1715 |
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