Crystallography Open Database
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Searching volume of publication is 15
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1000453 | CIF | Al F4 Rb | P 4/m m m | 3.6586; 3.6586; 6.3061 90; 90; 90 | 84.4 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1000454 | CIF | Al F4 Rb | P 4/m b m | 5.1375; 5.1375; 6.2912 90; 90; 90 | 166 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1000455 | CIF | Al F4 Rb | P 4/m b m | 5.1227; 5.1227; 6.2815 90; 90; 90 | 164.8 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1000456 | CIF | Al F4 Rb | P m m n :2 | 7.2285; 7.2252; 6.2624 90; 90; 90 | 327.1 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1000457 | CIF | Al F4 Rb | P m m n :2 | 7.2124; 7.2073; 6.2396 90; 90; 90 | 324.3 | Bulou, A; Nouet, J Structural phase transitions in ferroelastic Rb al F4: I. DSC, x-ray powder diffraction investigations and neutron powder profile refinement of the structures Journal of Physics C, 1982, 15, 183-196 |
| 1001291 | CIF | Cu2 La2 O6 Sr | I 4/m m m | 3.865; 3.865; 19.887 90; 90; 90 | 297.1 | Nguyen, N; Er-Rakho, L; Michel, C; Choisnet, J; Raveau, B Intercroissance de feuilletes "Perovskites lacunaires" et de feuillets type chlorure de sodium: les oxydes La~2-~x A~1+x~ Cu~2~ O~6-x/2~ (A = CA, SR) Materials Research Bulletin, 1980, 15, 891-897 |
| 1001292 | CIF | Cu2 La1.9 O5.95 Sr1.1 | I 4/m m m | 3.863; 3.863; 19.963 90; 90; 90 | 297.9 | Nguyen, N; Er-Rakho, L; Michel, C; Choisnet, J; Raveau, B Intercroissance de feuilletes "Perovskites lacunaires" et de feuillets type chlorure de sodium: les oxydes La~2-~x A~1+x~ Cu~2~ O~6-x/2~ (A = CA, SR) Materials Research Bulletin, 1980, 15, 891-897 |
| 1001293 | CIF | Ca1.1 Cu2 La1.9 O5.95 | I 4/m m m | 3.825; 3.825; 19.404 90; 90; 90 | 283.9 | Nguyen, N; Er-Rakho, L; Michel, C; Choisnet, J; Raveau, B Intercroissance de feuilletes "Perovskites lacunaires" et de feuillets type chlorure de sodium: les oxydes La~2-~x A~1+x~ Cu~2~ O~6-x/2~ (A = CA, SR) Materials Research Bulletin, 1980, 15, 891-897 |
| 1001780 | CIF | N2 O Si2 | C m c 21 | 8.869; 5.493; 4.849 90; 90; 90 | 236.2 | Billy, M; Labbe, J C; Selvaraj, A; Roult, G Modifications structurales de l'oxynitrure de silicium sous contraintes thermiques Materials Research Bulletin, 1980, 15, 1207-1213 |
| 1001781 | CIF | N2 O Si2 | C m c 21 | 8.884; 5.522; 4.873 90; 90; 90 | 239.1 | Billy, M; Labbe, J C; Selvaraj, A; Roult, G Modifications structurales de l'oxynitrure de silicium sous contraintes thermiques Materials Research Bulletin, 1980, 15, 1207-1213 |
| 1007139 | CIF | Cs2 H7 O10 P Te | P 1 21/n 1 | 8.204; 18.416; 6.995 90; 89.89; 90 | 1056.8 | Averbuch-Pouchot, M T; Durif, A; Guitel, J C Crystal structures of two cesium phosphate-tellurates: (Te(O H)~6~) (Cs~2~ H P O~4~) and (Te(O H)~6~) (Cs~2~ H P O~4~) (Cs H~2~ P O~4~)~2~ Materials Research Bulletin, 1980, 15, 387-395 |
| 1007140 | CIF | Cs4 H11 O18 P3 Te | P 1 21/m 1 | 9.591; 13.163; 8.367 90; 106.27; 90 | 1014 | Averbuch-Pouchot, M T; Durif, A; Guitel, J C Crystal structures of two cesium phosphate-tellurates: (Te(O H)~6~) (Cs~2~ H P O~4~) and (Te(O H)~6~) (Cs~2~ H P O~4~) (Cs H~2~ P O~4~)~2~ Materials Research Bulletin, 1980, 15, 387-395 |
| 1007141 | CIF | H3 K2 O8 P S | P 1 21/n 1 | 7.434; 7.341; 7.148 90; 99.56; 90 | 384.7 | Averbuch-Pouchot, M T; Durif, A Crystal structure of (K H SO~4~)(K H~2~ P O~4~) Materials Research Bulletin, 1980, 15, 427-430 |
| 1008034 | CIF | F6 W | P n m a | 9.603; 8.713; 5.044 90; 90; 90 | 422 | Levy, J H; Taylor, J C; Wilson, P W The Structures of Fluorides XIII: The Orthorhombic Form of Tungsten Hexafluoride at 193K by Neutron Diffraction Journal of Solid State Chemistry, 1975, 15, 360-365 |
| 1008111 | CIF | Cl H4 N O4 | P n m a | 9.2; 5.82; 7.45 90; 90; 90 | 398.9 | Smith, H G; Levy, H A Neutron Diffraction Study of Ammonium Perchlorate Acta Crystallographica (1,1948-23,1967), 1962, 15, 1201-1206 |
| 1008247 | CIF | Cu H3 O5 P | P 1 21/a 1 | 8.606; 6.346; 6.811 90; 94.16; 90 | 371 | Boudjada, A Structure cristalline de l'orthophosphate monoacide de cuivre monohydrate Cu (H P O~4~) (H~2~ O) Materials Research Bulletin, 1980, 15, 1083-1090 |
| 1008918 | CIF | H6 N2 O | F m -3 m | 6.76; 6.76; 6.76 90; 90; 90 | 308.9 | Zocchi, M.; Busing, W. R.; Ellison, R. D.; Levy, H. A. An X-ray study of hydrazine hydrate, N2 H4 (H2 O) Acta Crystallographica (1,1948-23,1967), 1962, 15, 803-803 |
| 1009043 | CIF | Fe S | P -6 2 c | 5.968; 5.968; 11.74 90; 90; 120 | 362.1 | Bertaut, F La structure de sulfure de fer Journal de Physique et du Radium, 1954, 15, 775-775 |
| 1010423 | CIF | Ba Te | F m -3 m | 6.82; 6.82; 6.82 90; 90; 90 | 317.2 | Spangenberg, K Lichtbrechungsbestimmungen an den Erdalkaliverbindungen mit O, S, Se und Te Naturwissenschaften, 1927, 15, 266-266 |
| 1010598 | CIF | C6 H8 N8 Pt S6 | P -3 m 1 | 6.77; 6.77; 10.45 90; 90; 120 | 414.8 | Hendricks, S B; Merwin, H E The Atomic Arrangement in Crystals of the Alkali Platini-Thiocyanates American Journal of Science, Serie 5(1,1921-1938), 1928, 15, 487-494 |
| 1010599 | CIF | C6 K2 N6 Pt S6 | P -3 m 1 | 6.73; 6.73; 10.26 90; 90; 120 | 402.4 | Hendricks, S B; Merwin, H E The Atomic Arrangement in Crystals of the Alkali Platini-thiocyanates American Journal of Science, Serie 5(1,1921-1938), 1928, 15, 487-494 |
| 1010600 | CIF | C6 N6 Pt Rb2 S6 | P -3 m 1 | 6.75; 6.75; 10.47 90; 90; 120 | 413.1 | Hendricks, S B; Merwin, H E The Atomic Arrangement in Crystals of the Alkali Platini-Thiocyanates American Journal of Science, Serie 5(1,1921-1938), 1928, 15, 487-494 |
| 1100072 | CIF | H12 Mg O9 S2 | P n m a | 9.32; 14.36; 6.87 90; 90; 90 | 919.4 | Nardelli, M; Fava, G; Giraldi, G The Crystal Structure of Magnesium Thiosulphate Hexahydrate Acta Crystallographica (1,1948-23,1967), 1962, 15, 227-231 |
| 1100097 | CIF | H8 Mg O8 S | P 1 21/n 1 | 5.922; 13.604; 7.905 90; 90.85; 90 | 636.8 | Baur, W. H. Zur Kristallchemie der Salzhydrate. Die Kristallstrukturen von MgSO~4~.4H~2~O (leonhardtit) und FeSO~4~.4H~2~O (rozenit) Acta Crystallographica, 1962, 15, 815-826 |
| 1100139 | CIF | C27 H37 Au Br4 N12 O9 | P -1 | 11.3215; 11.908; 16.4596 71.538; 71.675; 78.681 | 1986.6 | Esther R. Acuna-Cueva; Sonia B. Jimenez-Pulido; Miguel N. Moreno-Carretero; Miguel Quiros Structural Chemistry, 2004, 15, 159-163 |
| 1502622 | CIF | C18 H25 Cl N O2.5 | P 21 21 21 | 6.9608; 15.583; 31.3056 90; 90; 90 | 3395.7 | Shevchenko, Anna; Belle, David Din; Tiittanen, Saara; Karjalainen, Arto; Tolvanen, Arto; Tanninen, Veli Pekka; Haarala, Jorma; Mäkelä, Mikko; Yliruusi, Jouko; Miroshnyk, Inna Coupling Polymorphism/Solvatomorphism and Physical Stability Evaluation with Early Salt Synthesis Optimization of an Investigational Drug Organic Process Research & Development, 2011, 15, 666 |
| 1502623 | CIF | C74 H84 Cl2 N6 P2 Ru | C 1 2 1 | 24.264; 24.798; 26.166 90; 104.12; 90 | 15268 | Goto, Mitsutaka; Konishi, Takahiro; Kawaguchi, Shinji; Yamada, Masatoshi; Nagata, Toshiaki; Yamano, Mitsuhisa Process Research on the Asymmetric Hydrogenation of a Benzophenone for Developing the Manufacturing Process of the Squalene Synthase Inhibitor TAK-475 Organic Process Research & Development, 2011, 15, 1178 |
| 1508841 | CIF | C26 H24 | P 1 21/c 1 | 11.406; 5.8201; 15.187 90; 95.53; 90 | 1003.5 | Jiang, Huanfeng; Gao, Yang; Wu, Wanqing; Huang, Yubing Pd(II)-Catalyzed Highly Regio- and Stereoselective Assembly of C-C Double Bonds: An Efficient Method for the Synthesis of 2,4-Dihalo-1,3,5-trienes from Alkynols. Organic letters, 2013, 15, 238-241 |
| 1508842 | CIF | C17 H14 Br N O | P 21 21 21 | 6.1191; 12.656; 18.088 90; 90; 90 | 1400.8 | Cao, Zhong-Yan; Zhou, Feng; Yu, Yi-Hua; Zhou, Jian A Highly Diastereo- and Enantioselective Hg(II)-Catalyzed Cyclopropanation of Diazooxindoles and Alkenes. Organic letters, 2013, 15, 42-45 |
| 1508843 | CIF | C22 H31 N O2 | P 1 21 1 | 7.6187; 15.2421; 8.3982 90; 99.42; 90 | 962.09 | Martin, Rhia M.; Bergman, Robert G.; Ellman, Jonathan A. Synthesis of Isoquinuclidines from Highly Substituted Dihydropyridines via the Diels-Alder Reaction. Organic letters, 2013, 15, 444-447 |
| 1508844 | CIF | C15 H18 O4 | P 1 21/c 1 | 15.5908; 12.0381; 7.2191 90; 99.952; 90 | 1334.52 | Song, Liyan; Yao, Hongliang; Zhu, Liangyu; Tong, Rongbiao Asymmetric Total Syntheses of (-)-Penicipyrone and (-)-Tenuipyrone via Biomimetic Cascade Intermolecular Michael Addition/Cycloketalization. Organic letters, 2013, 15, 6-9 |
| 1508845 | CIF | C13 H16 O4 | P 1 21/c 1 | 10.6914; 9.8462; 11.5299 90; 110.216; 90 | 1138.98 | Song, Liyan; Yao, Hongliang; Zhu, Liangyu; Tong, Rongbiao Asymmetric Total Syntheses of (-)-Penicipyrone and (-)-Tenuipyrone via Biomimetic Cascade Intermolecular Michael Addition/Cycloketalization. Organic letters, 2013, 15, 6-9 |
| 1508846 | CIF | C12.5 H20 Cl2 Ir N O2 | P 21 21 21 | 12.8975; 14.6754; 16.4298 90; 90; 90 | 3109.8 | Wetzel, Alexander; Wöckel, Simone; Schelwies, Mathias; Brinks, Marion K.; Rominger, Frank; Hofmann, Peter; Limbach, Michael Selective Alkylation of Amines with Alcohols by Cp*-Iridium(III) Half-Sandwich Complexes. Organic letters, 2013, 15, 266-269 |
| 1508847 | CIF | C18 H23 N O3 | P -1 | 6.7576; 9.8259; 13.085 92.213; 97.254; 92.098 | 860.49 | Wang, Gang; Liu, Xiaohua; Huang, Tianyu; Kuang, Yulong; Lin, Lili; Feng, Xiaoming Asymmetric catalytic 1,3-dipolar cycloaddition reaction of nitrile imines for the synthesis of chiral spiro-pyrazoline-oxindoles. Organic letters, 2013, 15, 76-79 |
| 1508848 | CIF | C33 H29 N3 O3 | P 1 21 1 | 12.016; 18.7857; 12.339 90; 97.777; 90 | 2759.7 | Wang, Gang; Liu, Xiaohua; Huang, Tianyu; Kuang, Yulong; Lin, Lili; Feng, Xiaoming Asymmetric catalytic 1,3-dipolar cycloaddition reaction of nitrile imines for the synthesis of chiral spiro-pyrazoline-oxindoles. Organic letters, 2013, 15, 76-79 |
| 1508849 | CIF | C29 H31 N3 O3 S | P 21 21 21 | 9.0374; 15.0633; 19.6158 90; 90; 90 | 2670.4 | Wang, Gang; Liu, Xiaohua; Huang, Tianyu; Kuang, Yulong; Lin, Lili; Feng, Xiaoming Asymmetric catalytic 1,3-dipolar cycloaddition reaction of nitrile imines for the synthesis of chiral spiro-pyrazoline-oxindoles. Organic letters, 2013, 15, 76-79 |
| 1508850 | CIF | C36 H48 S4 Si2 | P 1 21/c 1 | 14.45; 16.149; 16.146 90; 110.285; 90 | 3534 | Dou, Chuandong; Saito, Shohei; Gao, Libin; Matsumoto, Naoki; Karasawa, Takashi; Zhang, Hongyu; Fukazawa, Aiko; Yamaguchi, Shigehiro Sequential Electrophilic and Photochemical Cyclizations from Bis(bithienyl)acetylene to a Tetrathienonaphthalene Core. Organic letters, 2013, 15, 80-83 |
| 1508851 | CIF | C36 H48 S4 Si2 | P -1 | 7.5456; 12.1175; 19.49 80.956; 88.114; 87.511 | 1757.6 | Dou, Chuandong; Saito, Shohei; Gao, Libin; Matsumoto, Naoki; Karasawa, Takashi; Zhang, Hongyu; Fukazawa, Aiko; Yamaguchi, Shigehiro Sequential Electrophilic and Photochemical Cyclizations from Bis(bithienyl)acetylene to a Tetrathienonaphthalene Core. Organic letters, 2013, 15, 80-83 |
| 1508852 | CIF | C36 H49 I S4 Si2 | P -1 | 8.5863; 12.175; 18.897 92.036; 96.456; 98.521 | 1938.5 | Dou, Chuandong; Saito, Shohei; Gao, Libin; Matsumoto, Naoki; Karasawa, Takashi; Zhang, Hongyu; Fukazawa, Aiko; Yamaguchi, Shigehiro Sequential Electrophilic and Photochemical Cyclizations from Bis(bithienyl)acetylene to a Tetrathienonaphthalene Core. Organic letters, 2013, 15, 80-83 |
| 1508853 | CIF | C52 H30 F6 S | P -1 | 11.2017; 12.1697; 15.1195 85.32; 82.624; 72.927 | 1951.88 | Li, Jing; Huang, Huanan; Liang, Weihong; Gao, Qun; Duan, Zheng Catalytic C-h and C-s bond activation of thiophenes. Organic letters, 2013, 15, 282-285 |
| 1508854 | CIF | C69 H52 S | P -1 | 10.4792; 13.4657; 20.0797 70.764; 77.704; 82.037 | 2606.7 | Li, Jing; Huang, Huanan; Liang, Weihong; Gao, Qun; Duan, Zheng Catalytic C-h and C-s bond activation of thiophenes. Organic letters, 2013, 15, 282-285 |
| 1508855 | CIF | C44 H35 F4 S | P 1 21/c 1 | 9.3242; 20.5863; 20.4716 90; 92.4025; 90 | 3926.09 | Li, Jing; Huang, Huanan; Liang, Weihong; Gao, Qun; Duan, Zheng Catalytic C-h and C-s bond activation of thiophenes. Organic letters, 2013, 15, 282-285 |
| 1508856 | CIF | C213 H201 S4 | P -1 | 16.0668; 16.7268; 18.1635 96.294; 99.037; 108.324 | 4510 | Li, Jing; Huang, Huanan; Liang, Weihong; Gao, Qun; Duan, Zheng Catalytic C-h and C-s bond activation of thiophenes. Organic letters, 2013, 15, 282-285 |
| 1508857 | CIF | C32 H29 Cl N2 O3 | P 21 21 21 | 8.3771; 10.29; 31.168 90; 90; 90 | 2686.69 | Shi, Feng; Xing, Gui-Juan; Zhu, Ren-Yi; Tan, Wei; Tu, Shujiang A Catalytic Asymmetric Isatin-Involved Povarov Reaction: Diastereo- and Enantioselective Construction of Spiro[indolin-3,2'-quinoline] Scaffold. Organic letters, 2013, 15, 128-131 |
| 1508858 | CIF | C28 H25 N O4 | P 1 21 1 | 12.652; 5.3373; 17.942 90; 109.082; 90 | 1145 | Wu, Hua; He, Yu-Ping; Gong, Liu-Zhu Direct Access to Enantioenriched Spiroacetals through Asymmetric Relay Catalytic Three-Component Reaction. Organic letters, 2013, 15, 460-463 |
| 1508859 | CIF | C15 H19 N O3 | P -1 | 6.9397; 8.8694; 11.1168 97.572; 94.165; 92.775 | 675.33 | Reddy, B. V. Subba; Reddy, M. Ramana; Rao, Y. Gopal; Yadav, J. S.; Sridhar, B. Cu(OTf)(2)-Catalyzed Synthesis of 2,3-Disubstituted Indoles and 2,4,5-Trisubstituted Pyrroles from α-Diazoketones. Organic letters, 2013, 15, 464-467 |
| 1508860 | CIF | C14 H15 N O2 | P 1 21/n 1 | 11.7298; 9.2723; 11.8853 90; 103.883; 90 | 1254.91 | Reddy, B. V. Subba; Reddy, M. Ramana; Rao, Y. Gopal; Yadav, J. S.; Sridhar, B. Cu(OTf)(2)-Catalyzed Synthesis of 2,3-Disubstituted Indoles and 2,4,5-Trisubstituted Pyrroles from α-Diazoketones. Organic letters, 2013, 15, 464-467 |
| 1508861 | CIF | C34 H32 N4 | P 1 21/c 1 | 13.046; 18.896; 21.809 90; 91.007; 90 | 5375 | Chandra, Brijesh; Mahanta, Sanjeev P.; Pati, Narendra N.; Baskaran, Sambath; Kanaparthi, Ravi K.; Sivasankar, Chinnappan; Panda, Pradeepta K. Calix[2]bispyrrolylarenes: New Expanded Calix[4]pyrroles for Fluorometric Sensing of Anions via Extended π-Conjugation. Organic letters, 2013, 15, 306-309 |
| 1508862 | CIF | C24 H16 N2 | P 1 21 1 | 7.6144; 7.5543; 29.9948 90; 91.624; 90 | 1724.65 | Louillat, Marie-Laure; Patureau, Frederic W. Toward polynuclear ru-cu catalytic dehydrogenative C-N bond formation, on the reactivity of carbazoles. Organic letters, 2013, 15, 164-167 |
| 1508863 | CIF | C24 H24 O4 | P -1 | 9.2295; 10.3951; 11.3783 86.591; 69.851; 79.622 | 1008.07 | Qin, Changming; Davies, Huw M. L. Enantioselective Synthesis of 2-Arylbicyclo[1.1.0]butane Carboxylates. Organic letters, 2013, 15, 310-313 |
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