Crystallography Open Database

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Searching space group like 'R -3 m'

COD ID: 1543136
CIF file Formula: - C2 Bi Cl6 K N2 -
Comments: Wei, Fengxia; Deng, Zeyu; Sun, Shijing; Xie, Fei; Kieslich, Gregor; Evans, Donald M.; Carpenter, Michael A.; Bristowe, Paul D.; Cheetham, Anthony K. The synthesis, structure and electronic properties of a lead-free hybrid inorganic‒organic double perovskite (MA)2KBiCl6(MA = methylammonium) Mater. Horiz. 3(4) (2016) 328
Space group: R -3 m
Cell volume: 1116.72
Cell parameters: 7.8372; 7.8372; 20.9938; 90; 90; 120;  

COD ID: 1544390
CIF file Formula: - Ba8 O22 V7 -
Comments: Liu, G.; Greedan, J.E. The synthesis, structure, and characterization of a novel 24-layer oxide: Ba8V7O22 with V(III), V(IV), and V(V) Journal of Solid State Chemistry 108 (1994) 371-380
Space group: R -3 m
Cell volume: 1653.6
Cell parameters: 5.7841; 5.7841; 57.074; 90; 90; 120;  

COD ID: 1544392
CIF file Formula: - D2.32 Mg2.45 O6 Si1.19 -
Comments: Tomioka, N.; Okuchi, T.; Purevjav, N.; Abe, J.; Harjo, S. Hydrogen sites in the dense hydrous magnesium silicate phase E: a pulsed neutron powder diffraction study Physics and Chemistry of Minerals 43 (2016) 267-475
Space group: R -3 m
Cell volume: 106.256
Cell parameters: 2.97065; 2.97065; 13.9033; 90; 90; 120;  

COD ID: 1544393
CIF file Formula: - D2.22 Mg2.28 O6 Si1.31 -
Comments: Tomioka, N.; Okuchi, T.; Purevjav, N.; Abe, J.; Harjo, S. Hydrogen sites in the dense hydrous magnesium silicate phase E: a pulsed neutron powder diffraction study :tilted O-D dipole model Physics and Chemistry of Minerals 43 (2016) 267-475
Space group: R -3 m
Cell volume: 106.256
Cell parameters: 2.97065; 2.97065; 13.9033; 90; 90; 120;  

COD ID: 1544456
CIF file Formula: - Ag O2 Yb -
Comments: Saito, A.; Sawaguchi, N.; Sasaki, M. Synthesis and crystal structure of AgYbO2 Journal of the Ceramic Society of Japan 116 (2008) 118-120
Space group: R -3 m
Cell volume: 179.35
Cell parameters: 3.372; 3.372; 18.214; 90; 90; 120;  

COD ID: 1544466
CIF file Formula: - Al7.9 N8.1 O1.9 Si1.1 -
Comments: Banno, H.; Asaka, T.; Fukuda, K. Electron density distribution and crystal structure of 27R-SiAlON, Si3-xAl6+xOxN10-x (x~1.9) Journal of the Ceramic Society of Japan 122 (2014) 281-287
Space group: R -3 m
Cell volume: 579.395
Cell parameters: 3.05991; 3.05991; 71.454; 90; 90; 120;  

COD ID: 1544498
CIF file Formula: - C7 Al7.52 Si0.48 Zr -
Comments: Iwata, T.; Hattori, E.; Sugiura, K.; Hashimoto, S.; Nakano, H.; Fukuda, K. Syntheses and crystal structures of Si-bearing layered carbides ZrAl8C7 and ZrAl4C4 Journal of the Ceramic Society of Japan 117 (2009) 37-41
Space group: R -3 m
Cell volume: 552.677
Cell parameters: 3.32214; 3.32214; 57.8236; 90; 90; 120;  

COD ID: 1544726
CIF file Formula: - Ba3 O8 P2 -
Comments: Sugiyama, K.; Tokonami, M. The crystal structure refinements of the strontium and barium orthophosphates Mineralogical Journal 15 (1990) 141-146
Space group: R -3 m
Cell volume: 571.1
Cell parameters: 5.6038; 5.6038; 21; 90; 90; 120;  

COD ID: 1544727
CIF file Formula: - O8 P2 Sr3 -
Comments: Sugiyama, K.; Tokonami, M. The crystal structure refinements of the strontium and barium orthophosphates Mineralogical Journal 15 (1990) 141-146
Space group: R -3 m
Cell volume: 497.81
Cell parameters: 5.3901; 5.3901; 19.785; 90; 90; 120;  

COD ID: 1546733
CIF file Formula: - Ag Al -
Comments: Zhang, Zezhong; Bourgeois, Laure; Rosalie, Julian M.; Medhekar, Nikhil V. The bi-layered precipitate phase ζ in the Al-Ag alloy system Acta Materialia 132 (2017) 525
Space group: R -3 m
Cell volume: 206.124
Cell parameters: 2.97545; 2.97545; 26.88393; 90; 90; 120;  

COD ID: 1550380
CIF file Formula: - C42 H30 O14 Ti3 -
Comments: Feng, Xuanyu; Song, Yang; Chen, Justin S.; Li, Zhe; Chen, Emily Y.; Kaufmann, Michael; Wang, Cheng; Lin, Wenbin Cobalt-Bridged Secondary Building Units in a Titanium Metal-Organic Framework Catalyze Cascade Reduction of N-Heteroarenes Chemical Science (2019)
Space group: R -3 m
Cell volume: 7901.2
Cell parameters: 25.8366; 25.8366; 13.6675; 90; 90; 120;  

COD ID: 1550666
CIF file Formula: - C14 H9 Cu N O4 -
Comments: Kong, Xiang-Jing; He, Tao; Zhang, Yongzheng; Wu, Xue-Qian; Wang, Si-Nan; Xu, Ming-Ming; Si, Guang-Rui; Li, Jian-Rong Jeff Constructing New Metal-Organic Frameworks with Complicated Ligands Generated from “One-Pot” In Situ Reactions Chemical Science (2019)
Space group: R -3 m
Cell volume: 10346.5
Cell parameters: 18.6355; 18.6355; 34.4019; 90; 90; 120;  

COD ID: 1550672
CIF file Formula: - C14 H9 N O4 Zn -
Comments: Kong, Xiang-Jing; He, Tao; Zhang, Yongzheng; Wu, Xue-Qian; Wang, Si-Nan; Xu, Ming-Ming; Si, Guang-Rui; Li, Jian-Rong Jeff Constructing New Metal-Organic Frameworks with Complicated Ligands Generated from “One-Pot” In Situ Reactions Chemical Science (2019)
Space group: R -3 m
Cell volume: 10120.4
Cell parameters: 18.4038; 18.4038; 34.5026; 90; 90; 120;  

COD ID: 2000778
CIF file

Original IUCr paper

Formula: - Er K Te2 -
Comments: Keane, P. M.; Ibers, J. A. Structure of KErTe~2~ Acta Crystallographica Section C 48(7) (1992) 1301-1303
Space group: R -3 m
Cell volume: 408.8
Cell parameters: 4.41; 4.41; 24.27; 90; 90; 120;  

COD ID: 2001032
CIF file

Original IUCr paper

Formula: - K2 Mn O6 Se2 -
Comments: Wildner, M. Structure of K~2~Mn(SeO~3~)~2~, a further buetschliite-type selenite Acta Crystallographica Section C 48(3) (1992) 595
Space group: R -3 m
Cell volume: 509.69
Cell parameters: 5.615; 5.615; 18.667; 90; 90; 120;  

COD ID: 2002091
CIF file

Original IUCr paper

Formula: - C38 H56 Cu2 N2 O8 -
Comments: Fujita, T.; Ohba, S.; Tokii, T.; Kato, M. Dimeric copper(II) 2,2-dimethylpropanoate adducts with 3- or 4-picoline Acta Crystallographica Section C 49(1) (1993) 144-147
Space group: R -3 m
Cell volume: 9793
Cell parameters: 31.902; 31.902; 11.111; 90; 90; 120;  

COD ID: 2009516
CIF file

Original IUCr paper

Formula: - Fe Lu O4 Zn -
Comments: Isobe, M.; Kimizuka, N.; Nakamura, M.; Mohri, T. Structures of LuFeO~3~(ZnO)~<i>m~</i> (<i>m</i> =1, 4, 5 and 6) Acta Crystallographica Section C 50(3) (1994) 332-336
Space group: R -3 m
Cell volume: 257.7
Cell parameters: 3.4185; 3.4185; 25.463; 90; 90; 120;  

COD ID: 2009518
CIF file

Original IUCr paper

Formula: - Fe Lu O8 Zn5 -
Comments: Isobe, M.; Kimizuka, N.; Nakamura, M.; Mohri, T. Structures of LuFeO~3~(ZnO)~<i>m~</i> (<i>m</i> =1, 4, 5 and 6) Acta Crystallographica Section C 50(3) (1994) 332-336
Space group: R -3 m
Cell volume: 542.87
Cell parameters: 3.3291; 3.3291; 56.56; 90; 90; 120;  

COD ID: 2017179
CIF file

HKL data

Original IUCr paper

Formula: - H4 K2 Mn3 O12 P4 -
Comments: Hamchaoui, Farida; Alonzo, Véronique; Roisnel, Thierry; Rebbah, Houria; Le Fur, Eric Dipotassium trimanganese(II) tetrakis(hydrogenphosphite), K~2~[Mn~3~(HPO~3~)~4~] Acta Crystallographica Section C 65(7) (2009) i33-i35
Space group: R -3 m
Cell volume: 911.06
Cell parameters: 5.4489; 5.4489; 35.4321; 90; 90; 120;  

COD ID: 2101456
CIF file

Original IUCr paper

Formula: - Pu0.6 U0.4 -
Comments: Lawson, A. C.; Goldstone, J. A.; Cort, B.; Martinez, R. J.; Vigil, F. A.; Zocco, T. G.; Richardson, Jnr, J. W.; Mueller, M. H. Structure of ζ-phase plutonium‒uranium Acta Crystallographica Section B 52(1) (1996) 32-37
Space group: R -3 m
Cell volume: 1219.98
Cell parameters: 10.68535; 10.68535; 10.68535; 89.7364; 89.7364; 89.7364;  

COD ID: 2101457
CIF file

Original IUCr paper

Formula: - Pu0.6 U0.4 -
Comments: Lawson, A. C.; Goldstone, J. A.; Cort, B.; Martinez, R. J.; Vigil, F. A.; Zocco, T. G.; Richardson, Jnr, J. W.; Mueller, M. H. Structure of ζ-phase plutonium‒uranium Acta Crystallographica Section B 52(1) (1996) 32-37
Space group: R -3 m
Cell volume: 3659.9
Cell parameters: 15.0765; 15.0765; 18.5925; 90; 90; 120;  

COD ID: 2103392
CIF file

Original IUCr paper

Formula: - C24 H54 N8 -
Comments: Marsh, Richard E. The space groups of point group <i>C</i>~3~: some corrections, some comments Acta Crystallographica Section B 58(5) (2002) 893-899
Space group: R -3 m
Cell volume: 2099.95
Cell parameters: 14.555; 14.555; 11.446; 90; 90; 120;  

COD ID: 2103394
CIF file

Original IUCr paper

Formula: - C15 H9 O9 Os3 Rh -
Comments: Marsh, Richard E. The space groups of point group <i>C</i>~3~: some corrections, some comments Acta Crystallographica Section B 58(5) (2002) 893-899
Space group: R -3 m
Cell volume: 2996
Cell parameters: 14.411; 14.411; 16.658; 90; 90; 120;  

COD ID: 2103406
CIF file

Original IUCr paper

Formula: - C26 H56 Au B Cl6 F4 P2 -
Comments: Marsh, Richard E. The space groups of point group <i>C</i>~3~: some corrections, some comments Acta Crystallographica Section B 58(5) (2002) 893-899
Space group: R -3 m
Cell volume: 5820.46
Cell parameters: 11.308; 11.308; 52.56; 90; 90; 120;  

COD ID: 4001823
CIF file Formula: - C9 H10 B5 Cu O5 -
Comments: Kennedy, Robert D.; Krungleviciute, Vaiva; Clingerman, Daniel J.; Mondloch, Joseph E.; Peng, Yang; Wilmer, Christopher E.; Sarjeant, Amy A.; Snurr, Randall Q.; Hupp, Joseph T.; Yildirim, Taner; Farha, Omar K.; Mirkin, Chad A. Carborane-Based Metal‒Organic Framework with High Methane and Hydrogen Storage Capacities Chemistry of Materials 25(17) (2013) 3539
Space group: R -3 m
Cell volume: 11846.6
Cell parameters: 18.6953; 18.6953; 39.1379; 90; 90; 120;  

COD ID: 4121692
CIF file Formula: - C20 H8 Cu2 N2 O11 -
Comments: Li, Bin; Wen, Hui-Min; Wang, Hailong; Wu, Hui; Tyagi, Madhusudan; Yildirim, Taner; Zhou, Wei; Chen, Banglin A porous metal-organic framework with dynamic pyrimidine groups exhibiting record high methane storage working capacity. Journal of the American Chemical Society 136(17) (2014) 6207-6210
Space group: R -3 m
Cell volume: 11400.8
Cell parameters: 18.6895; 18.6895; 37.6886; 90; 90; 120;  

COD ID: 4344913
CIF file Formula: - Al Na O2 -
Comments: Reid, A.F.; Ringwood, A.E. High-pressure NaAlO2, and alpha-NaFeO2 isotype Inorganic Chemistry 7 (1968) 443-445
Space group: R -3 m
Cell volume: 113.1
Cell parameters: 2.868; 2.868; 15.88; 90; 90; 120;  

COD ID: 4514295
CIF file Formula: - C30 H30 Cd2 Cl9 N20 O11.17 -
Comments: Yao, Yu-Qing; Zhang, Ying-Jie; Zhang, Yun-Qian; Tao, Zhu; Ni, Xin-Long; Wei, Gang Multiple Efficient Fluorescence Emission from Cucurbit[10]uril-[Cd4Cl16]8‒Based Pillared Diamond Porous Supramolecular Frameworks. ACS applied materials & interfaces 9(46) (2017) 40760-40765
Space group: R -3 m
Cell volume: 38245
Cell parameters: 38.586; 38.586; 29.661; 90; 90; 120;  

COD ID: 5910049
CIF file Formula: - Cu Pt -
Comments: Wyckoff, R. W. G. Page 225 from the second edition of Structure of Crystals by Wyckoff. published by The Chemical Catalog Company, INC, New York in 1931 & http://cst-www.nrl.navy.mil/lattice/ The second edition of Structure of Crystals (1931) 225-225
Space group: R -3 m
Cell volume: 53.575
Cell parameters: 3.77; 3.77; 3.77; 90.54; 90.54; 90.54;  

COD ID: 5910127
CIF file Formula: - Cl2 Ni -
Comments: Wyckoff, R. W. G. Pages 233 & 238 from the second edition of Structure of Crystals by Wyckoff R W G.published by The Chemical Catalog Company, INC, New York in 1931. The second edition of Structure of Crystals (1931) 233-238
Space group: R -3 m
Cell volume: 62.291
Cell parameters: 6.13; 6.13; 6.13; 33.36; 33.36; 33.6;  

COD ID: 5910154
CIF file Formula: - Cl2 Zn -
Comments: Wyckoff, R. W. G. Pages 233 & 239 from the second edition of Structure of Crystals by Wyckoff R W G. Published by The Chemical Catalog Company, INC, New York in 1931. The second edition of Structure of Crystals (1931) 233-239
Space group: R -3 m
Cell volume: 71.831
Cell parameters: 6.31; 6.31; 6.31; 34.48; 34.48; 34.48;  

COD ID: 6000111
CIF file Formula: - Ba2 La0.66 O8 V2 -
Comments: Skakle, J. M. S.; Coats, A. M.; Marr, J. The crystal structures of Ba2R2/3V2O8 (R = La, Nd) and Sr2La2/3V2O8; palmierite derivatives Journal of Materials Science 35 (2000) 3251-3256
Space group: R -3 m
Cell volume: 603.22
Cell parameters: 5.7527; 5.7527; 21.0473; 90; 90; 120;  

COD ID: 6000144
CIF file Formula: - Cu5.59 Ho2 P4.5 -
Comments: Mozharivskyj, Y.; Kuz'ma, Y. B. Ternary phosphide Ho2Cu6-xP5-y, its crystal structure, and REm+n(Cu2P3)(m)(Cu4P2)(n) relationship with other rhombohedral rare-earth copper phosphides Journal of Solid State Chemistry 151 (2000) 150-156
Space group: R -3 m
Cell volume: 555.21
Cell parameters: 3.976; 3.976; 40.554; 90; 90; 120;  

COD ID: 6000159
CIF file Formula: - B12 Re13 Tb8 -
Comments: Mykhalenko, S. I.; Kuz'ma, Y. B. The Tb-Re-B system: Phase equilibria and crystal structures Polish Journal of Chemistry 74 (2000) 163-171
Space group: R -3 m
Cell volume: 1399.37
Cell parameters: 10.6233; 10.6233; 14.318; 90; 90; 120;  

COD ID: 6000241
CIF file Formula: - In2 O8 Zn5 -
Comments: Pitschke, W.; Koumoto, K. Powder diffraction data and Rietveld refinement for Y-doped (ZnO)(5)In2O3 Powder Diffraction 14 (1999) 213-218
Space group: R -3 m
Cell volume: 557.71
Cell parameters: 3.3285; 3.3285; 58.127; 90; 90; 120;  

COD ID: 6000242
CIF file Formula: - In1.6 O8 Y0.4 Zn5 -
Comments: Pitschke, W.; Koumoto, K. Powder diffraction data and Rietveld refinement for Y-doped (ZnO)(5)In2O3 Powder Diffraction 14 (1999) 213-218
Space group: R -3 m
Cell volume: 562.54
Cell parameters: 3.3505; 3.3505; 57.863; 90; 90; 120;  

COD ID: 6000359
CIF file Formula: - La7 Mo7 O30 -
Comments: Goutenoire, F.; Retoux, R.; Suard, E.; Lacorre, P. Ab initio determination of the novel perovskite-related structure of La7Mo7O30 from powder diffraction Journal of Solid State Chemistry 142 (1999) 228-235
Space group: R -3 m
Cell volume: 1983.93
Cell parameters: 17.0051; 17.0051; 6.8607; 90; 90; 90;  

COD ID: 6000432
CIF file Formula: - Cu7.65 P8 Y3 -
Comments: Kuz'ma, Y. B.; Chykhrij, S. I.; Mozharivsky, Y. A.; Tremel, W.; Demchyna, R. O. New ternary phosphides Ln(3-x)Cu(8-y)P(8) (Ln=Y, Gd, Tb, Dy, Ho, Er, Tm) and their crystal structure Journal of Alloys and Compounds 278 (1998) 169-174
Space group: R -3 m
Cell volume: 820.05
Cell parameters: 3.968; 3.968; 60.14; 90; 120; 90;  

COD ID: 6000688
CIF file Formula: - N2 Sr Zr -
Comments: Gregory, D. H.; Barker, M. G.; Edwards, P. P.; Siddons, D. J. Synthesis and structure of two new layered ternary nitrides, SrZrN2 and SrHfN2 Inorganic Chemistry 35 (1996) 7608-7613
Space group: R -3 m
Cell volume: 174.16
Cell parameters: 3.373; 3.373; 17.6756; 90; 90; 120;  

COD ID: 6000689
CIF file Formula: - Hf N2 Sr -
Comments: Gregory, D. H.; Barker, M. G.; Edwards, P. P.; Siddons, D. J. Synthesis and structure of two new layered ternary nitrides, SrZrN2 and SrHfN2 Inorganic Chemistry 35 (1996) 7608-7613
Space group: R -3 m
Cell volume: 171.28
Cell parameters: 3.3448; 3.3448; 17.6779; 90; 90; 120;  

COD ID: 6000743
CIF file Formula: - K N O2 -
Comments: Onoda-Yamamuro, N.; Honda, H.; Ikeda, R.; Yamamuro, O.; Matsuo, T.; Oikawa, K.; Kamiyama, T.; Izumi, F. Neutron powder diffraction study of the low-temperature phases of KNO2 Journal of Physics: Condensed Matter 10 (1998) 3341-3351
Space group: R -3 m
Cell volume: 220.15
Cell parameters: 5.0279; 5.0279; 10.0559; 90; 90; 120;  

COD ID: 6000763
CIF file Formula: - Ca2 N -
Comments: Gregory, D. H.; Bowman, A.; Baker, C. F.; Weston, D. P. Dicalcium nitride, Ca2N - a 2D "excess electron" compound; synthetic routes and crystal chemistry Journal of Materials Chemistry 10 (2000) 1635-1641
Space group: R -3 m
Cell volume: 217.72
Cell parameters: 3.6287; 3.6287; 19.0921; 90; 90; 120;  

COD ID: 7043151
CIF file Formula: - C10 H7 Cu N O5 -
Comments: Gupta, Anoop K.; De, Dinesh; Bharadwaj, Parimal K. A NbO type Cu(II) metal‒organic framework showing efficient catalytic activity in Friedländer and Henry reactions Dalton Trans. (2017)
Space group: R -3 m
Cell volume: 11127
Cell parameters: 18.604; 18.604; 37.123; 90; 90; 120;  

COD ID: 7045347
CIF file Formula: - C12 H18 B12 Cl12 Fe N6 -
Comments: Musgrave, Rebecca Alice; Hailes, Rebekah; Schäfer, André; Russell, Andrew David; Gates, Paul Jonathan; Manners, Ian New Reactivity at the Silicon Bridge in Sila[1]ferrocenophanes Dalton Transactions (2018)
Space group: R -3 m
Cell volume: 2668.28
Cell parameters: 11.3371; 11.3371; 23.9716; 90; 90; 120;  

COD ID: 7119826
CIF file Formula: - C193.68 H54 Cu18 N18 O117 -
Comments: Xiaoping Zhang; Zhenjie Zhang; Jake Boissonnault; Seth M. Cohen Design and synthesis of squaramide-based MOFs as efficient MOF-supported hydrogen-bonding organocatalysts Chem.Commun. 52 (2016) 8585
Space group: R -3 m
Cell volume: 11453.3
Cell parameters: 18.2623; 18.2623; 39.6543; 90; 90; 120;  

COD ID: 7119827
CIF file Formula: - C180 H54 N18 O108 Zn18 -
Comments: Xiaoping Zhang; Zhenjie Zhang; Jake Boissonnault; Seth M. Cohen Design and synthesis of squaramide-based MOFs as efficient MOF-supported hydrogen-bonding organocatalysts Chem.Commun. 52 (2016) 8585
Space group: R -3 m
Cell volume: 11779
Cell parameters: 18.816; 18.816; 38.416; 90; 90; 120;  

COD ID: 7121584
CIF file Formula: - C102 H102 Ag12 F18 N8 O12 S6 -
Comments: Zang, Shuang-Quan; Du, Xiang-Sha; Yan, Bing-Jie; Wang, Jia-Yin; Xi, Xiao-Juan; Wang, Zhao-Yang Layer-sliding-driven crystal size and photoluminescence change in a novel SCC-MOF Chemical Communications (2018)
Space group: R -3 m
Cell volume: 10968
Cell parameters: 25.14; 25.14; 20.039; 90; 90; 120;  

COD ID: 7123351
CIF file Formula: - Bi -
Comments: Wei, Zheng; Dubceac, Cristina; Petrukhina, Marina A.; Dikarev, Evgeny V. From a volatile molecular precursor to twin-free single crystals of bismuth Chemical Communications (2019)
Space group: R -3 m
Cell volume: 211.18
Cell parameters: 4.5392; 4.5392; 11.8347; 90; 90; 120;  

COD ID: 7123352
CIF file Formula: - Bi -
Comments: Wei, Zheng; Dubceac, Cristina; Petrukhina, Marina A.; Dikarev, Evgeny V. From a volatile molecular precursor to twin-free single crystals of bismuth Chemical Communications (2019)
Space group: R -3 m
Cell volume: 212.46
Cell parameters: 4.5481; 4.5481; 11.86; 90; 90; 120;  

COD ID: 7221587
CIF file Formula: - C11 H5 O5 Zn -
Comments: Yang, Jie; Zhang, Liangliang; wang, xiao qing; Wang, Rongming; Dai, Fangna; Sun, Daofeng Fluorescent Selectivity for Small Molecules of Three Zn-MOFs with different Topologies Based on a Tetracarboxylate Ligand RSC Adv. (2015)
Space group: R -3 m
Cell volume: 11938
Cell parameters: 19.0926; 19.0926; 37.8155; 90; 90; 120;  


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