Crystallography Open Database

Result: there are 678 entries in the selection

Switch to the old layout of the page

Download all results as: list of COD numbers | list of CIF URLs | data in CSV format | archive of CIF files (ZIP)

Searching space group like 'F d d d :2'

Blue left arrow Blue left arrow First | Blue left arrow Previous 50 | of 14 | Next 50 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

COD ID Blue up arrow Links Formula Up arrow Space group Up arrow Cell parameters Cell volume Up arrow Bibliography
1532236 CIFH2 Na2 O7 P2F d d d :227.521; 12.3519; 6.8597
90; 90; 90
2331.86Selevich, K.A.; Ivashkevich, L.S.; Selevich, A.F.; Lyakhov, A.S.
Refinement of crystal structure of Na2 H2 P2 O7 using X-ray powder diffraction data
Zhurnal Neorganicheskoi Khimii, 2002, 47, 1672-1675
1532679 CIFSb Sn TiF d d d :25.4892; 9.845; 19.151
90; 90; 90
1034.94Dashjav, E.; Kleinke, H.
Sn/Sb atom ordering in the ternary stannide-antimonide Ti Sn Sb
Journal of Solid State Chemistry, 2003, 176, 329-337
1533877 CIFF6 H2 K2 O SnF d d d :211.689; 13.7492; 17.6484
90; 90; 90
2836.35Kavun, V.Ya.; Tkachenko, I.A.; Gabuda, S.P.; Gerasimenko, A.V.; Trofimov, G.L.
Crystal structure refinement of K2 Sn F6 * (H2 O) using single crystal (1)H NMR data
Zhurnal Strukturnoi Khimii (Issue-No. from 1981), 2002, 43, 382-386
1534192 CIFCl3 IrF d d d :26.95; 9.81; 20.82
90; 90; 90
1419.5Babel, D.; Deigner, P.
Die Kristallstruktur von Iridium(III)-Chlorid-beta
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1965, 339, 57-66
1534477 CIFCs Mo O6 PF d d d :210.971; 12.601; 16.035
90; 90; 90
2216.77Leclaire, A.; Guesdon, A.; Borel, M.M.; Berrah, F.; Raveau, B.
Two molybdenum(VI) monophosphates with a tunnel structure : A Mo O2 P O4 (A = Cs, Tl) and structural relationships in the series.
Solid State Sciences, 2001, 3, 877-882
1534479 CIFMo O6 P TlF d d d :210.851; 12.452; 15.872
90; 90; 90
2144.57Leclaire, A.; Guesdon, A.; Borel, M.M.; Berrah, F.; Raveau, B.
Two molybdenum(VI) monophosphates with a tunnel structure : A Mo O2 P O4 (A = Cs, Tl) and structural relationships in the series.
Solid State Sciences, 2001, 3, 877-882
1534581 CIFH45 K7 Na9 O91.5 P2 Pt W18F d d d :228.596; 31.788; 38.347
90; 90; 90
34857.8Anderson, T.M.; Neiwert, W.A.; Kirk, M.L.; Rui Cao,; Piccoli, P.M.B.; Schultz, A.J.; Koetzle, F.; Hill, C.L.; Keiji Morokuma,; Musaev, D.G.
A Late-Transition Metal Oxo Complex: K7 Na9 [O=PtIV (H2 O)L2], L = [P W9 O34]9-
Science, 2004, 306, 2074-2077
1534583 CIFH49.2 K7.6 Na1.4 O90.5 P2 Pd0.3 W18.7F d d d :228.637; 31.735; 38.228
90; 90; 90
34741.4Anderson, T.M.; Musaev, D.G.; Kirk, M.L.; Neiwert, W.A.; Schultz, A.J.; Piccoli, P.M.B.; Koetzle, F.
A Late-Transition Metal Oxo Complex: K7 Na9 [O=PtIV (H2 O)L2], L = [P W9 O34]9-
Science, 2004, 306, 2074-2077
1534585 CIFH45 K7 Na9 O91.5 P2 Pt0.5 W18F d d d :228.494; 31.687; 37.988
90; 90; 90
34299Anderson, T.M.; Neiwert, W.A.; Kirk, M.L.; Koetzle, F.; Piccoli, P.M.B.; Schultz, A.J.; Musaev, D.G.
A Late-Transition Metal Oxo Complex: K7 Na9 [O=PtIV (H2 O) L2], L = [P W9 O34]9-
Science, 2004, 306, 2074-2077
1535331 CIFIn1.3 Ir Mg0.7F d d d :29.808; 5.281; 17.973
90; 90; 90
930.93Hlukhyy, V.; Poettgen, R.; Hoffmann, R.D.
Synthesis and crystal structures of the pseudobinary intermetallics Ir In2-x Mgx with orthorhombic Mg2 Cu structure and Ir Mg3-x Inx with hexagonal Cu3 P Type
Intermetallics, 2004, 12, 383-387
1535333 CIFIn1.47 Ir Mg0.53F d d d :29.819; 5.288; 17.992
90; 90; 90
934.196Hlukhyy, V.; Hoffmann, R.D.; Poettgen, R.
Synthesis and crystal structures of the pseudobinary intermetallics Ir In2-x Mgx with orthorhombic Mg2 Cu structure and Ir Mg3-x Inx with hexagonal Cu3 P Type
Intermetallics, 2004, 12, 383-387
1535633 CIFLi Rb2 S4 VF d d d :25.8134; 13.083; 23.164
90; 90; 90
1761.78Huang, F.Q.; Deng, B.; Ibers, J.A.
Syntheses and structures of six compounds in the A2 Li M S4 (A = K, Rb, Cs; M = V, Nb, Ta) family
Journal of Solid State Chemistry, 2005, 178, 194-199
1535637 CIFCs2 Li S4 VF d d d :25.8316; 13.6095; 24.177
90; 90; 90
1918.81Huang, F.Q.; Ibers, J.A.; Deng, B.
Syntheses and structures of six compounds in the A2 Li M S4 (A = K, Rb, Cs; M = V, Nb, Ta) family
Journal of Solid State Chemistry, 2005, 178, 194-199
1536008 CIFH16 O18 P4 Zn4F d d d :29.679; 11.926; 30.691
90; 90; 90
3542.72Chen Wenbin; Xiang Shouhe; Li Niu
Zn3 (H P O3)4.Zn (H2 O)6: a purely inorganic open-framework zincophosphite with octahedral zinc complex (Zn (H2 O)6)(2+) encapsulating in the channels
Journal of Solid State Chemistry, 2004, 177, 3229-3234
1536138 CIFH4 O10 Si U2F d d d :28.297; 11.219; 18.661
90; 90; 90
1737.04Nozik, Yu.Z.; Kuznetsov, L.M.
Neutron diffraction study of synthetic soddyite by the full-profile analysis technique
Kristallografiya, 1990, 35, 1563-1564
1536619 CIFK12 Na2 O220 Si4 U4 W40F d d d :224.18; 31.696; 58.012
90; 90; 90
44460.9Kim Kee-Chan; Gaunt, A.; Pope, M.T.
New heteropolytungstates incorporating dioxouranium(VI). Derivatives of alpha-(Si W9 O34)(10-), alpha-(As W9 O33)(9-), gamma-(Si W10 O36)(8-) and (As4 W40 O140)(28-)
Journal of Cluster Science, 2002, 13, 423-436
1536626 CIFLu2 S3F d d d :210.7735; 7.7053; 22.837
90; 90; 90
1895.77Kim, S.-J.; Anderegg, J.W.; Franzen, H.F.
Structure of a new intermediate Lu2-x S3
Journal of the Less-Common Metals, 1990, 157, 133-138
1537039 CIFEu Ga2 Se4F d d d :221.579; 21.336; 12.736
90; 90; 90
5863.78Rimet, R.; Roques, R.; Declercq, J.P.; Zanchetta, J.V.; Germain, G.
Structure cristalline et proprietes magnetiques de Eu Ga2 Se4
Revue de Chimie Minerale, 1981, 18, 277-285
1537087 CIFS8F d d d :210.393; 12.762; 24.436
90; 90; 90
3241.08Krossing, I.; Cameron, T.S.; Min Fang; Dionne, I.; Decken, A.; Passmore, J.
Approaching the gas phase structures of AgS8+ and AgS16+ in the solid state
Chemistry - A European Journal, 2002, 8, 3386-3401
1537136 CIFCs2 Mn Sn Te4F d d d :26.8189; 15.063; 25.967
90; 90; 90
2667.15Zimmermann, C.; Dehnen, S.
Cs2 (Mn Sn Te4): ungewoehnliche Synthese einer quaternaeren Phase mit eindimensionalen, ternaeren Anionenstraengen
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 1553-1556
1537523 CIFCa Ga2 Se4F d d d :221.06; 21; 12.66
90; 90; 90
5599.01Klee, W.; Schaefer, H.
Darstellung und Struktur von Ba Al2 Se4, Ba Ga2 Se4, Ca Ga2 Se4 und Ca In2 Te4
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1981, 479, 125-133
1543200 CIFC376 H490 Cd24 Cl4 N24 O136 Yb8F d d d :254.07; 60.708; 90.132
90; 90; 90
295857Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.
Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications.
Nanoscale, 2016, 8, 11123-11129
1543201 CIFC376 H490 Cd24 Cl4 N24 Nd8 O136F d d d :254.405; 61.195; 91.022
90; 90; 90
303041Yang, Xiaoping; Wang, Shiqing; Schipper, Desmond; Zhang, Lijie; Li, Zongping; Huang, Shaoming; Yuan, Daqiang; Chen, Zhongning; Gnanam, Annie J.; Hall, Justin W.; King, Tyler L.; Que, Emily; Dieye, Yakhya; Vadivelu, Jamuna; Brown, Katherine A.; Jones, Richard A.
Self-assembly of high-nuclearity lanthanide-based nanoclusters for potential bioimaging applications.
Nanoscale, 2016, 8, 11123-11129
1544300 CIFC12 H8 N2F d d d :29.2584; 12.936; 15.764
90; 90; 90
1888Bajpai, Alankriti; Scott, Hayley S.; Pham, Tony; Chen, Kai-Jie; Space, Brian; Lusi, Matteo; Perry, Miranda L.; Zaworotko, Michael J.
Towards an understanding of the propensity for crystalline hydrate formation by molecular compounds
IUCrJ, 2016, 3
1548242 CIFC136 H144 Cu8 N24 O60F d d d :210.9218; 23.5976; 34.2826
90; 90; 90
8835.6Fernández de Luis, Roberto; Larrea, Edurne S.; Orive, Joseba; Fidalgo-Marijuan, Arkaitz; Lezama, Luis; Arriortua, María I
Open and closed forms of the interpenetrated [Cu<sub>2</sub>(Tae)(Bpa)<sub>2</sub>](NO<sub>3</sub>)<sub>2</sub>·nH<sub>2</sub>O: magnetic properties and high pressure CO<sub>2</sub>/CH<sub>4</sub> gas sorption.
Dalton transactions (Cambridge, England : 2003), 2018, 47, 958-970
1548243 CIFC136 H144 Cu8 N24 O54.4F d d d :211.1575; 23.7123; 33.583
90; 90; 90
8885.1Fernández de Luis, Roberto; Larrea, Edurne S.; Orive, Joseba; Fidalgo-Marijuan, Arkaitz; Lezama, Luis; Arriortua, María I
Open and closed forms of the interpenetrated [Cu<sub>2</sub>(Tae)(Bpa)<sub>2</sub>](NO<sub>3</sub>)<sub>2</sub>·nH<sub>2</sub>O: magnetic properties and high pressure CO<sub>2</sub>/CH<sub>4</sub> gas sorption.
Dalton transactions (Cambridge, England : 2003), 2018, 47, 958-970
1548340 CIFCl16 Cu16 O8F d d d :27.4477; 9.5989; 9.6888
90; 90; 90
692.65Li Zhao; Maria Teresa Fernandez-Diaz; Liu Hao Tjeng; Alexander C. Komarek
Oxyhalides: A new class of high-TC multiferroic materials
Science Advances, 2016, 2, 1600353
1548505 CIFC156 H120 Ag4 Cl12 O16 P8F d d d :219.4287; 36.4741; 42.9932
90; 90; 90
30466.9Lin Rong Er
Gold rectangle, silver rings and helices - A study of self-assembly and molecular recognition of metallo-supramolecules
Ph.D Thesis - NATIONAL UNIVERSITY OF SINGAPORE, 2005, 1
1549307 CIFC386 H560 Cd24 N24 O190 Tb8F d d d :254.777; 61.944; 79.935
90; 90; 90
271228Yang, Xiaoping; Wang, Shiqing; Zhang, Yali; Liang, Guang; Zhu, Ting; Zhang, Lijie; Huang, Shaoming; Schipper, Desmond; Jones, Richard A.
A self-assembling luminescent lanthanide molecular nanoparticle with potential for live cell imaging.
Chemical science, 2018, 9, 4630-4637
1549308 CIFC1714.04 H2526.4 Cd96 N96 O683.24 Tb32F d d d :254.621; 61.479; 100.21
90; 90; 90
336510Yang, Xiaoping; Wang, Shiqing; Zhang, Yali; Liang, Guang; Zhu, Ting; Zhang, Lijie; Huang, Shaoming; Schipper, Desmond; Jones, Richard A.
A self-assembling luminescent lanthanide molecular nanoparticle with potential for live cell imaging.
Chemical science, 2018, 9, 4630-4637
1551281 CIFC60 H116 O16 P4 Ti4F d d d :215.2031; 21.8563; 43.312
90; 90; 90
14391.9Kraemer, Tobias; Tuna, Floriana; Pike, Sebastian D.
Photo-redox reactivity of titanium-oxo clusters: mechanistic insight into a two-electron intramolecular process, and structural characterisation of mixed-valent Ti(III)/Ti(IV) products
Chemical Science, 2019
1551366 CIFC422 H343.5 Cl Co10 F114 N76 O46 P7.5 S23F d d d :270.5877; 79.1494; 80.8163
90; 90; 90
451519Imogen A. Riddell; Maarten M. J. Smulders; Jack K. Clegg; Yana R. Hristova; Boris Breiner; John D. Thoburn; Jonathan R. Nitschke
Anion-induced reconstitution of a self-assembling system to express a chloride-binding Co10L15 pentagonal prism
Nature Chemistry, 2012, 4, 751-756
1551367 CIFC423 H345 Cl Co10 F111 N76 O47 P7 S23F d d d :270.759; 79.508; 81.13
90; 90; 90
456430Imogen A. Riddell; Maarten M. J. Smulders; Jack K. Clegg; Yana R. Hristova; Boris Breiner; John D. Thoburn; Jonathan R. Nitschke
Anion-induced reconstitution of a self-assembling system to express a chloride-binding Co10L15 pentagonal prism
Nature Chemistry, 2012, 4, 751-756
1554015 CIFC12 H14 I N OF d d d :217.0726; 21.6048; 26.727
90; 90; 90
9858.3Sun, Xingxing; Zhang, Baicheng; Li, Xinyang; Trindle, Carl O.; Zhang, Guoqing
External Heavy-Atom Effect via Orbital Interactions Revealed by Single-Crystal X-ray Diffraction.
The journal of physical chemistry. A, 2016, 120, 5791-5797
1554349 CIFC5.5 H5.62 N0.12 O0.5F d d d :224.1341; 25.4123; 26.638
90; 90; 90
16337.2Gong, Hai-Xian; Cao, Zhu; Li, Meng-Hua; Liao, Sai-Hu; Lin, Mei-Jin
Photoexcited perylene diimide radical anions for the reduction of aryl halides: a bay-substituent effect
Organic Chemistry Frontiers, 2018, 5, 2296
1555262 CIFC20 H28.9 O8F d d d :27.3713; 22.951; 23.585
90; 90; 90
3990.1Cui, Peng; McMahon, David P.; Spackman, Peter R.; Alston, Ben M.; Little, Marc A.; Day, Graeme M.; Cooper, Andrew I.
Mining predicted crystal structure landscapes with high throughput crystallisation: old molecules, new insights
Chemical Science, 2019, 10, 9988
1557220 CIFS8F d d d :210.331; 12.6786; 24.3519
90; 90; 90
3189.7MIKURIYA, Masahiro; TANIGUCHI, Kazuki; KOYAMA, Yoshiki; WATANABE, Hiroaki; YOSHIOKA, Daisuke; MITSUHASHI, Ryoji; ASATO, Eiji
Crystal Structure of S<sub>8</sub> Molecule from Thiourea
X-ray Structure Analysis Online, 2020, 36, 1-2
1557585 CIFC37 H61 Eu N8 O15F d d d :218.1194; 20.3557; 43.9834
90; 90; 90
16222.5Hewitt, Sarah H.; Macey, Georgina; Mailhot, Romain; Elsegood, Mark R. J.; Duarte, Fernanda; Kenwright, Alan M.; Butler, Stephen J.
Tuning the anion binding properties of lanthanide receptors to discriminate nucleoside phosphates in a sensing array
Chemical Science, 2020, 11, 3619-3628
1558822 CIFC39.44 H32.02 Fe2 N13.14 O1.15F d d d :27.0648; 26.4382; 45.215
90; 90; 90
8445.3Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.
Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion
Chemical Science, 2020
1558823 CIFC36 H24 Fe2 N12 Na0.51F d d d :27.0813; 26.493; 45.483
90; 90; 90
8533Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.
Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion
Chemical Science, 2020
1558824 CIFC36 H24 Fe2 K2.01 N12F d d d :27.081; 26.535; 45.388
90; 90; 90
8528Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.
Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion
Chemical Science, 2020
1558825 CIFC36 H24 Fe2 N12 Na2.04F d d d :27.0835; 26.4668; 45.398
90; 90; 90
8511.1Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.
Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion
Chemical Science, 2020
1558826 CIFC36 H24 Fe2 Li2 N12F d d d :27.0748; 26.4454; 45.3279
90; 90; 90
8480.7Biggins, Naomi; Ziebel, Michael E.; Gonzalez, Miguel; Long, Jeffrey R.
Crystallographic Characterization of the Metal‒Organic Framework Fe2(bdp)3 upon Reductive Cation Insertion
Chemical Science, 2020
1559037 CIFC20 H18 Cu F12 N6 P2F d d d :29.418; 13.472; 40.834
90; 90; 90
5181Sletten, Jorunn; Svardal, Kristin; Sorensen, Astrid
Coordination Geometries in Bis(di-2-pyridylamine)copper(II) Complexes. Crystal Structures of [CuL2](PF6)2, [CuL2(NO3)2] and [CuL2(NCS)1.5(ClO4)0.5][CuL2(NCS)]2(ClO4)2 (L = Di-2-pyridylamine)
Acta Chemica Scandinavica, 1993, 47, 1091-1099
1559543 CIFC22 H44 Cl4 N8F d d d :210.577; 17.419; 31.889
90; 90; 90
5875Dale, Johannes; Romming, Christian; Sigvartsen, Turid
Conformation of 1,3,7,9,13,15,19,21-octaazaquinquecyclo [19.3.1.1(3,7).1(9,13).1(15,19)]octacosane
Acta Chemica Scandinavica, 1991, 45, 1071-1075
1560606 CIFC40 H60 N8 Ni4 O42F d d d :214.4277; 24.0577; 33.9348
90; 90; 90
11778.7Xu, Qing-Qing; Liu, Bing; Xu, Ling; Jiao, Huan
Ionothermal synthesis and structural transformation targeted by ion exchange in metal-1,3,5-benzenetricarboxylate compounds
Journal of Solid State Chemistry, 2017, 247, 1-7
1560607 CIFC40 H56 Co4 N8 O42F d d d :214.3454; 24.1072; 34.1451
90; 90; 90
11808.3Xu, Qing-Qing; Liu, Bing; Xu, Ling; Jiao, Huan
Ionothermal synthesis and structural transformation targeted by ion exchange in metal-1,3,5-benzenetricarboxylate compounds
Journal of Solid State Chemistry, 2017, 247, 1-7
1560839 CIFC52 H61 Co3 N8 O19.5 S6F d d d :211.746; 42.15; 51.849
90; 90; 90
25670Dubskikh, Vadim A.; Lysova, Anna A.; Samsonenko, Denis G.; Lavrov, Alexander N.; Kovalenko, Konstantin A.; Dybtsev, Danil N.; Fedin, Vladimir P.
3D Metal-Organic Frameworks Based on Co(II) and Bithiophendicarboxylate: Synthesis, Crystal Structures, Gas Adsorption, and Magnetic Properties.
Molecules (Basel, Switzerland), 2021, 26, 1269
1560999 CIFC56 H46 N8 Ni2 O8 SiF d d d :216.693; 21.059; 89.25
90; 90; 90
31375Li, Qi; Guo, Tiantian; Lv, Xin; Lin, Yifang; Dai, Zhihui; Fang, Min; Bao, Jianchun; Wu, Yong
Two Ni(II) semiconducting metal-organic frameworks based on the tetrakis(4-carboxyphenyl)silane and an imidazole ligand: Syntheses, characterization, water stability and photoelectric properties
Journal of Solid State Chemistry, 2018, 265, 100-108
1561211 CIFC28 H30 Cu F4 N8 O6F d d d :219.0611; 23.7425; 27.1964
90; 90; 90
12308Liu, Kang; Sun, Yayong; Deng, Liming; Cao, Fan; Han, Jishu; Wang, Lei
Cu(II) coordination polymers constructed by tetrafluoroterephthalic acid and varied imidazole-containing ligands: Syntheses, structures and properties
Journal of Solid State Chemistry, 2018, 258, 24-31

Blue left arrow Blue left arrow First | Blue left arrow Previous 50 | of 14 | Next 50 Blue right arrow | Last Blue right arrow Blue right arrow | Display 5 20 50 100 200 300 500 1000 entries per page

Back to the search form
Your own data is not in the COD? Deposit it, thanks!