Crystallography Open Database

Result: there are 327 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 'I 1 2/m 1'

Left arrow Left arrow First | Left arrow Previous 100 | of 4 | Next 100 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
1000046 CIFCa5 H10 O22 Si6I 1 2/m 15.593; 3.645; 22.45599
90; 96.97; 90		454.4Hoffmann, C; Armbruster, T
Clinotobermorite, Ca5 (Si3 O8 (O H))2 . 4(H2 O) Ca5 (Si6 O17) . 5 (H2 O), a natural C-S-H(I) type cement mineral: determination of the substructure
Zeitschrift fuer Kristallographie (149,1979-), 1997, 212, 863-873
1008058 CIFNi Rh2 Se4I 1 2/m 16.2821; 3.6491; 10.844
90; 92.24; 90		248.4Bouchard, R J
The crystal structure and transport properties of Ni Rh~2~ Se~4~
Inorganic Chemistry, 1969, 8, 850-856
1008079 CIFCr2 Ni S4I 1 2/m 15.94; 3.42; 11.14
90; 91.05; 90		226.3Andron, B; Bertaut, E F
Etude par Diffraction neutronique de Cr~2~ Ni S~4~
Journal de Physique (Paris), 1966, 27, 619-626
1008813 CIFBa1.2 Mg1.2 O16 Ti6.8I 1 2/m 110.227; 14.907; 9.964
90; 90.77; 90		1518.9Fanchon, E.; Vicat, J.; Hodeau, J. L.; Wolfers, P.; Duc Tran Qui; Strobel, P.
Commensurate ordering and domains in the Ba1.2 Ti6.8 Mg1.2 O16 Hollandite.
Acta Crystallographica B (39,1983-), 1987, 43, 440-448
1008921 CIFCr3 Se4I 1 2/m 16.299; 3.607; 11.731
90; 91.87; 90		266.4Chevreton, M; Bertaut, F
Etude de seleniures de chrome.
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965), 1961, 253, 145-147
1008948 CIFBa1.2 Mg1.2 O16 Ti6.8I 1 2/m 110.227; 2.981; 9.964
90; 90.77; 90		303.7Fanchon, E; Vicat, J; Hodeau, J L; Wolfers, P; Duc Tran Qui; Strobel, P
Commensurate ordering and domains in the Ba1.2 Ti6.8 Mg1.2 O16 hollandite.
Acta Crystallographica B (39,1983-), 1987, 43, 440-448
1010188 CIFCl6 K2 TeI 1 2/m 17.17; 7.17; 10.14
90; 90; 90		521.3Engel, G
Die Kristallstrukturen einiger Hexachlorokomplexsalze.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1935, 90, 341-373
1011146 CIFCa2 H2 Mg5 O24 Si8I 1 2/m 19.78; 17.79999; 5.26
90; 73.97; 90		880.1Warren, B E
The crystal structure and chemical composition of the monoclinic amphiboles.
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1930, 72, 493-516
1011222 CIFCa2 H2 Mg5 O24 Si8I 1 2/m 19.77; 17.79999; 5.26
90; 73.97; 90		879.2Warren, B E
The structure of tremolite H2 Ca2 Mg5 (Si O3)8
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1929, 72, 42-57
1510367 CIFAu2 Br6 Rb2I 1 2/m 18.52; 7.243; 11.21
90; 101.24; 90		678.504Koelmel, M.; Straehle, J.; Gelinek, J.
Ueber den thermischen Abbau einiger Alkalimetall- und Ammoniumhalogenoaurate(III) und die Kristallstruktur der Zersetzungsprodukte Rb2 Au2 Br6, Rb3 Au3 Cl8 und Au (N H3) Cl3
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1979, 456, 241-460
1510540 CIFAu4 In7 La3I 1 2/m 14.6042; 13.895; 10.396
90; 90; 90		665.088Poettgen, R.; Hoffmann, R.D.; Galadzhun, Ya.V.; Zaremba, V.I.; Kal'ichak, Ya.M.
The Structure of La3 Au4 In7 and its relation to the Ba Al4 Type
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2000, 626, 1773-1777
1510868 CIFB28 Tb1.069I 1 2/m 15.855; 10.3354; 8.2808
90; 89.512; 90		501.084Zhang, F.; Tanaka, T.; Mori, T.
Synthesis and magnetic properties of binary boride RE B25 compounds
Journal of Physics: Condensed Matter, 2001, 13, 423-430
1513977 CIFLi2.72 Mn6.64 O16I 1 2/m 19.834; 2.7846; 10.191
90; 92.27; 90		278.85Botkovitz, P.; Brec, R.; Deniard, P.; Tournoux, M.; Burr, G.
Electrochemical and neutron diffraction study of a prelithiated hollandite-type Lix Mn O2 phase
Molecular Crystals and Liquid Crystals, 1994, 244, 233-238
1515794 CIFC68 H88 Cl2 Ge2 O2I 1 2/m 114.3831; 10.975; 19.628
90; 95.579; 90		3083.7Peng, Yang; Fischer, Roland C.; Merrill, W. Alexander; Fischer, Jelena; Pu, Lihung; Ellis, Bobby D.; Fettinger, James C.; Herber, Rolfe H.; Power, Philip P.
Substituent effects in ditetrel alkyne analogues: multiple vs. single bonded isomers
Chemical Science, 2010, 1, 461
1515795 CIFC72 H84 Cl2 Sn2I 1 2/m 114.908; 11.003; 19.38
90; 98.493; 90		3144.1Peng, Yang; Fischer, Roland C.; Merrill, W. Alexander; Fischer, Jelena; Pu, Lihung; Ellis, Bobby D.; Fettinger, James C.; Herber, Rolfe H.; Power, Philip P.
Substituent effects in ditetrel alkyne analogues: multiple vs. single bonded isomers
Chemical Science, 2010, 1, 461
1521081 CIFBi18 O42 P4 Pb5I 1 2/m 111.885; 11.54; 15.636
90; 90.23; 90		2144.5Giraud, S.; Steinfink, H.; Swinnea, S.; Wignacourt, J.P.; Harlow, R.
Crystal structure of Pb5 Bi18 P4 O42: a fluorite-related superstructure
Journal of Solid State Chemistry, 2000, 151, 181-189
1521773 CIFCr2.75 Ni0.25 S4I 1 2/m 15.8693; 3.41244; 11.055
90; 91.544; 90		221.336Powell, A.V.; Colgan, D.C.; Ritter, C.
Magnetic structure and spin reorientation in the ternary sulfides, Nix Cr3-x S4 (x = 1/4, 1/2, 3/4)
Journal of Solid State Chemistry, 1999, 143, 163-173
1521774 CIFCr2.5 Ni0.5 S4I 1 2/m 15.891; 3.41377; 11.101
90; 91.67; 90		223.152Powell, A.V.; Colgan, D.C.; Ritter, C.
Magnetic structure and spin reorientation in the ternary sulfides, Nix Cr3-x S4 (x = 1/4, 1/2, 3/4)
Journal of Solid State Chemistry, 1999, 143, 163-173
1524792 CIFFe3 Ni2 Se4I 1 2/m 16.17; 3.56; 10.94
90; 91.73; 90		240.19Lambert-Andron, B.; Babot, D.; Berodias, G.
Structures magnetiques des composes M Fe2 Se4 (M = Ti, V, Cr, Fe, Co, Ni)
Journal of Physics and Chemistry of Solids, 1972, 33, 87-87
1525987 CIFMn0.55 O1.7 Ta0.45I 1 2/m 13.5005; 3.573; 5.0015
90; 91.677; 90		62.528Esmaeilzadeh, S.; Lidin, S.; Nygren, M.; Grins, J.
Single crystal refinement of the incommensurately modulated Mn0.55 Ta0.45 O1.7, an oxygen deficient fluorite type compound
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2000, 626, 148-159
1526700 CIFD26 Eu6 Mg7I 1 2/m 114.0939; 5.6455; 11.509
90; 90.683; 90		915.673Kohlmann, H.; Bertheville, B.; Hansen, T.; Yvon, K.
High-pressure synthesis of novel europium magnesium hydrides
Journal of Alloys Compd., 2001, 322, 59-68
1526759 CIFBa Ce0.85 O2.925 Y0.15I 1 2/m 16.231; 8.76; 6.214
90; 90.58; 90		339.165Takeuchi, K.; Loong, C.-K.; Richardson, J.W.jr.; Guan, J.; Dorris, S.E.; Balachandran, U.
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Solid State Ionics, 2000, 138, 63-77
1526761 CIFBa Ce0.8 O2.9 Y0.2I 1 2/m 16.242; 8.731; 6.23
90; 91.15; 90		339.46Takeuchi, K.; Dorris, S.E.; Loong, C.-K.; Guan, J.; Richardson, J.W.jr.; Balachandran, U.
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Solid State Ionics, 2000, 138, 63-77
1526763 CIFBa Ce0.75 O2.875 Y0.25I 1 2/m 16.239; 8.726; 6.235
90; 91.24; 90		339.363Takeuchi, K.; Loong, C.-K.; Balachandran, U.; Guan, J.; Dorris, S.E.; Richardson, J.W.jr.
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Solid State Ionics, 2000, 138, 63-77
1526768 CIFBa Ce0.7 O2.85 Y0.3I 1 2/m 16.243; 8.725; 6.243
90; 91.54; 90		339.934Takeuchi, K.; Balachandran, U.; Loong, C.-K.; Richardson, J.W.jr.; Guan, J.; Dorris, S.E.
The crystal structures and phase transitions in Y-doped Ba Ce O3: their dependence on Y concentration and hydrogen doping
Solid State Ionics, 2000, 138, 63-77
1526784 CIFC59 Na3.82I 1 2/m 111.24; 11.71; 10.25
90; 96.08; 90		1341.52Kubozono, Y.; Fujiki, S.; Kambe, T.; Takabayashi, Y.; Kashino, S.; Emura, S.
Structure and physical properties of Na4 C60 under ambient and highpressure
Physical Review, Serie 3. B - Condensed Matter (18,1978-), 2001, 63, 0454181-0454189
1527085 CIFCr6.665 Te7.998I 1 2/m 16.857; 3.954; 12.272
90; 91.17; 90		332.656Andresen, A.F.
The magnetic structure of Cr2 Te3, Cr3 Te4 and Cr5 Te6
Acta Chemica Scandinavica (1-27,1973-42,1988), 1970, 24, 3495-3509
1527086 CIFFe3 Se4I 1 2/m 16.208; 3.541; 11.281
90; 91.807; 90		247.862Andresen, A.F.; van Laar, R.
The magnetic structure of Fe3 Se4
Acta Chemica Scandinavica (1-27,1973-42,1988), 1970, 24, 2435-2439
1528320 CIFBa2 H20 K4 Mn Na4 O66 Si16 Ti8I 1 2/m 114.2446; 13.7884; 15.5
90; 116.709; 90		2719.53Armbruster, T.; Krivovichev, S.V.; Organova, N.N.; Weber, T.; Gnos, E.; Yakovenchuk, V.N.; Shlyukova, Z.V.
Origin of diffuse superstructure reflections in labuntsovite-group minerals
American Mineralogist, 2004, 89, 1655-1666
1528499 CIFBa2 Nb Nd O6I 1 2/m 16.07918; 6.04547; 8.53909
90; 90.134; 90		313.824Fu, W.T.; Ijdo, D.J.W.
New insight into the symmetry and the structure of the double perovskites Ba2 Ln Nb O6 (Ln = lanthanides and Y)
Journal of Solid State Chemistry, 2006, 179, 1022-1028
1528503 CIFBa2 La Nb O6I 1 2/m 16.14448; 6.09131; 8.604
90; 90.348; 90		322.024Fu, W.T.; Ijdo, D.J.W.
New insight into the symmetry and the structure of the double perovskites Ba2 Ln Nb O6 (Ln = lanthanides and Y)
Journal of Solid State Chemistry, 2006, 179, 1022-1028
1528560 CIFLa4 O7 PtI 1 2/m 19.7993; 4.0014; 9.4905
90; 91.759; 90		371.956Hansen, T.J.; Macquart, R.B.; zur Loye, H.C.; Smith, M.D.
Crystal growth and structures of three new platinates: Ln3 Na Pt O7 (Ln = La, Nd) and La4 Pt O7
Solid State Sciences, 2007, 9, 785-791
1528637 CIFLa1.667 Mg O6 TaI 1 2/m 15.6304; 5.6226; 7.9434
90; 90.04; 90		251.468Khalyavin, D.D.; Vieira, L.G.; Senos, A.M.R.; Argyriou, D.N.; Gomes, I.T.; Mantas, P.Q.; Ribeiro, J.L.
Structure and dielectric characterization of a new A-site deficient La5/3 Mg Ta O6 perovskite
Journal of Solid State Chemistry, 2007, 180, 41-48
1529095 CIFH0.95 Mo O3I 1 2/m 114.5263; 3.7944; 7.7219
90; 93.727; 90		424.72Adams, S.; Moretzki, O.; Canadell, E.
Global instability index optimisation for the localization of mobile protons
Solid State Ionics, 2004, 168, 281-290
1530968 CIFMo2 S4 VI 1 2/m 15.949; 3.236; 11.67
90; 92.91; 90		224.369Wada, H.; Nozaki, H.; Onoda, M.; Kawada, I.
Phase relations and structure of V3-x Mox S4 (0<x<2)
Journal of Solid State Chemistry, 1986, 63, 369-376
1531183 CIFD26 Mg7 Sr6I 1 2/m 114.254; 5.6711; 11.575
90; 90.588; 90		935.626Bertheville, B.; Kohlmann, H.; Sheptyakov, D.; Yvon, K.
Sr6 Mg7 H26, a new saline high-pressure hydride with (Ba6 Zn7 F26)-type structure
Journal of Alloys Compd., 2003, 356, 128-132
1531989 CIFCl1.16 Fe7.6 H9.56 Ni0.4 O16I 1 2/m 110.587; 3.0311; 10.515
90; 90.03; 90		337.429Post, J.E.; Heaney, P.J.; von Dreele, R.B.; Hanson, J.C.
Neutron and temperature-resolved synchrotron X-ray powder diffraction study of akaganeite
American Mineralogist, 2003, 88, 782-788
1532432 CIFC0.8 B14 Y0.6I 1 2/m 18.278; 10.327; 5.86
90; 90.46; 90		500.937Zhang, F.X.; Xu, F.F.; Leithe-Jasper, A.; Mori, T.; Salamakha, P.; Sato, A.; Tanaka, T.; Bando, Y.
Incorporation of carbon atoms in rare earth boron-rich solids and formation of superstructures
Journal of Alloys Compd., 2002, 337, 120-127
1532433 CIFC4.513 B25 Y1.01I 1 2/m 116.0238; 21.7577; 5.6412
90; 90.182; 90		1966.74Zhang, F.X.; Xu, F.F.; Leithe-Jasper, A.; Mori, T.; Salamakha, P.; Tanaka, T.; Sato, A.; Bando, Y.
Incorporation of carbon atoms in rare earth boron-rich solids and formation of superstructures
Journal of Alloys Compd., 2002, 337, 120-127
1532808 CIFCo0.6 Cr2 Cu0.4 Se4I 1 2/m 16.288; 3.608; 11.728
90; 91.304; 90		266.005Okonska-Kozlowska, I.; Maciazek, E.; Ratuszna, A.
Crystal structure of Cu Cr2 Se4, Cu0.8 Co0.2 Cr2 Se4 and Cu0.4 Co0.6 Cr2 Se4
Applied Crystallography: Proceedings of the XVII International Conference Wisla, Poland 31 August-4 September, 1997, 2001, 18, 54-57
1533416 CIFBi18 O42 P4 Pb5I 1 2/m 111.9539; 11.6004; 15.724
90; 90.25; 90		2180.43Giraud, S.; Obbade, S.; Suard, E.; Wignacourt, J.P.; Steinfink, H.
Structures and ionic conductivities in two fluorite type families: Pb5 Bi17 X5 O43 and Pb5 Bi18 X4 O42 (X = P, V and As)
Solid State Sciences, 2003, 5, 335-341
1533804 CIFBa5.93 O80 Ti40I 1 2/m 19.9942; 14.7851; 10.2655
90; 90.88; 90		1516.7Hoeche, T.; Ruessel, C.; Keding, R.; Olhe, P.; van Aken, P.A.; Schneider, R.; Stemmer, S.; Wang Xiqu; Jacobson, A.J.; Kleebe, H.J.
Synthesis and characterization of mixed-valence barium titanates
Philosophical Magazine, Serie 8(1956-), 2003, 83, 165-178
1534361 CIFCr3 Se4I 1 2/m 16.32; 3.62; 11.77
90; 91.67; 90		269.164Chevreton, M.; Bertaut, E.F.
Etude de seleniures de chrome.
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965), 1961, 253, 145-147
1536345 CIFCs2 Cu3 F10 MgI 1 2/m 17.149; 7.368; 9.404
90; 96.29; 90		492.363Kaiser, V.; Dahlke, P.; Babel, D.
Struktur und Magnetismus von Fluoriden Cs2 M Cu3 F10 (M= Mg, Mn, Co, Ni), Varianten des (CsCu2F5)-Typs
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 993-1000
1536349 CIFCs2 Cu3 F10 NiI 1 2/m 17.163; 7.377; 9.382
90; 97.09; 90		491.968Kaiser, V.; Dahlke, P.; Babel, D.
Struktur und Magnetismus von Fluoriden Cs2 M Cu3 F10 (M = Mg, Mn, Co, Ni), Varianten des (Cs Cu2 F5) - Typs
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 993-1000
1536353 CIFCo Cs2 Cu3 F10I 1 2/m 17.178; 7.391; 9.394
90; 97.49; 90		494.124Kaiser, V.; Dahlke, P.; Babel, D.
Struktur und Magnetismus von Fluoriden Cs2 M Cu3 F10 (M = Mg, Mn, Co, Ni), Varianten des (Cs Cu2 F5) - Typs
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2002, 628, 993-1000
1536800 CIFH11.5 K0.45 Mn Na5.8 Nb0.25 O32 Si10 Ti0.75I 1 2/m 113.033; 18.717; 12.264
90; 99.62; 90		2949.59Yamnova, N.A.; Egorov-Tismenko, Yu.K.; Khomyakov, A.P.
Crystal structure of a new natural (Na, Mn, Ti)-phyllosilicate
Kristallografiya, 1996, 41, 257-262
1537570 CIFFe3 Se4I 1 2/m 16.2; 3.53; 11.26
90; 91.73; 90		246.324Lambert-Andron, B.; Berodias, G.
Etude par diffraction neutronique de Fe3 Se4
Solid State Communications, 1969, 7, 623-629
1541112 CIFBa Bi O3I 1 2/m 16.1908; 6.145; 8.6785
90; 90.164; 90		330.15Pei, S.; Jorgensen, J.D.; Dabrowski, B.; Sinha, S.K.; Vaknin, D.; Mitchell, A.W.; Hinks, D.G.; Richards, D.R.; Newsam, J.M.; Jacobson, A.J.
Structural phase diagram of the Ba1-x Kx Bi O3 system
Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1990, 41, 4126-4141
1541113 CIFBa0.9 Bi K0.1 O3I 1 2/m 16.1551; 6.1088; 8.6256
90; 90.077; 90		324.325Pei, S.; Jorgensen, J.D.; Hinks, D.G.; Dabrowski, B.; Jacobson, A.J.; Newsam, J.M.; Richards, D.R.; Mitchell, A.W.; Vaknin, D.; Sinha, S.K.
Structural phase diagram of the Ba1-x Kx Bi O3 system
Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1990, 41, 4126-4141
1541776 CIFC3 H7 Cl N6I 1 2/m 18.5287; 17.0442; 9.1844
90; 92.165; 90		1334.14Jing, H.-P.; Stroebele, M.; Weisser, M.; Meyer, H.J.
Die Kristallstruktur von wasserfreiem Melaminiumchlorid
Zeitschrift fuer Anorganische und Allgemeine Chemie, 2003, 629, 368-370
1544360 CIFIn O6 Sr2 TaI 1 2/m 15.7764; 5.776; 8.1566
90; 90.09; 90		272.14Zhou, Q.; Kennedy, B.J.; Avdeev, M.
Crystal struture and phase transitions in Sr2InTaO6 sample: 600 ?C
Physics and Chemistry of Minerals, 2013, 40, 603-610
1544721 CIFBa0.08 Fe0.15 K1.21 Mn7.85 Na0.44 O16I 1 2/m 19.907; 2.865; 9.676
90; 90.52; 90		274.6Kubo, H.; Miura, H.; Hariya, Y.
Tetragonal-monoclinic transformation of cryptomelane at high temperature
Mineralogical Journal, 1990, 15, 50-63
1550680 CIFC138 H202 F19 N6 O18 S6I 1 2/m 118.9188; 10.3807; 35.7997
90; 97.509; 90		6970.4Mandal, Debdeep; Sobottka, Sebastian; Dolai, Ramapada; Maiti, Avijit; Dhara, Debabrata; Kalita, Pankaj; Narayanan, Ramakirushnan Surya; Chandrasekhar, Vadapalli; Sarkar, Biprajit; Jana, Anukul
Direct Access to 2-Aryl Substituted Pyrrolinium Salts for Carbon Centre Based Radicals without Pyrrolidine-2-Ylidene alias cyclic(Alkyl)(Amino)Carbene (CAAC) as a Precursor
Chemical Science, 2019
1551545 CIFC246 H126 Co6 N8 P6 Te8I 1 2/m 126.5695; 17.056; 21.1219
90; 104.26; 90		9276.9Evan S. O'Brien; M. Tuan Trinh; Rose L. Kann; Jia Chen; Giselle A. Elbaz; Amrita Masurkar; Timothy L. Atallah; Maria V. Paley; Nilam Patel; Daniel W. Paley; Ioannis Kymissis; Andrew C. Crowther; Andrew J. Millis; David R. Reichman; X.-Y. Zhu; Xavier Roy
Single-crystal-to-single-crystal intercalation of a low-bandgap superatomic crystal
Nature Chemistry, 2017, 9, 1170-1174
1557509 CIFC53 H31 Cu2 N O12I 1 2/m 125.8186; 22.6806; 27.2079
90; 109.69; 90		15000.9Bloch, Witold M.; Babarao, Ravichandar; Schneider, Matthew L.
On/off porosity switching and post-assembly modifications of Cu4L4 metal‒organic polyhedra
Chemical Science, 2020, 11, 3664-3671
1559160 CIFC12.8 H10 Fe N10 O0.4 PtI 1 2/m 114.8483; 7.1717; 15.88
90; 92.699; 90		1689.1Turo-Cortés, Rubén; Bartual-Murgui, Carlos; Castells-Gil, Javier; Muñoz, Carmen; Martí-Gastaldo, Carlos; Real Cabezos, José Antonio A
Reversible guest-induced gate-opening with multiplex spin crossover responses in two-dimensional Hofmann Clathrates
Chemical Science, 2020
1559162 CIFC12.8 H10 Fe N10 O0.4 PtI 1 2/m 114.9798; 7.3662; 16.181
90; 91.922; 90		1784.5Turo-Cortés, Rubén; Bartual-Murgui, Carlos; Castells-Gil, Javier; Muñoz, Carmen; Martí-Gastaldo, Carlos; Real Cabezos, José Antonio A
Reversible guest-induced gate-opening with multiplex spin crossover responses in two-dimensional Hofmann Clathrates
Chemical Science, 2020
1560371 CIFC9 H15 B F4 N6I 1 2/m 110.535; 6.4885; 18.7172
90; 92.323; 90		1278.39Stubbe, Jessica; Suhr, Simon; Beerhues, Julia; Nößler, Maite; Sarkar, Biprajit
The transformations of a methylene-bridged bis-triazolium salt: a mesoionic carbene based metallocage and analogues of TCNE and NacNac
Chemical Science, 2021, 12, 3170-3178
1561443 CIFC60 H90 Al6 Cu7.33I 1 2/m 112.9999; 17.2545; 16.5285
90; 97.741; 90		3673.7Schütz, Max; Gemel, Christian; Muhr, Maximilian; Jandl, Christian; Kahlal, Samia; Saillard, Jean-Yves; Fischer, Roland A.
Exploring Cu/Al cluster growth and reactivity: from embryonic building blocks to intermetalloid, open-shell superatoms.
Chemical science, 2021, 12, 6588-6599
1562683 CIF
HKL		C30 H38 Cu2 N4 O19I 1 2/m 18.8717; 18.8801; 9.9362
90; 100.916; 90		1634.19Nour Dissem; Prabhjyot Kaur; Love Karan Rana; Thierry Maris; Adam Duong
Synthesis, characterization and Hirshfeld surface analysis of a mixed-ligand copper (II) coordination polymer from 1,4,8,11-tetraazacyclotetradecane and pyromellitic dianhydride
Transition Metal Chemistry, 2021, 46, 283-290
1565706 CIFC18 H18 Cl2 Cu N12 O9I 1 2/m 115.599; 10.704; 21.315
90; 105; 90		3438Hua, Zi-Yi; Chen, Chen; Zhou, Fu-Hou; Zhang, Hao; Zhu, Zhao Qiang; Ge, Wei-Wei; Chen, Kai
Anion control in the complexation of cucurbit[6]uril with Cu(II) salts
Inorganica Chimica Acta, 2020, 499, 119183
1567307 CIFC46 H64 N2 O2I 1 2/m 113.809; 8.7376; 17.19
90; 99.585; 90		2045.1Reid, Amelia G.; Moreno, Juan J.; Hooe, Shelby L.; Baugh, Kira R.; Thomas, Isobel H.; Dickie, Diane A.; Machan, Charles W.
Inverse potential scaling in co-electrocatalytic activity for CO2 reduction through redox mediator tuning and catalyst design
Chemical Science, 2022, 13, 9595-9606
1568589 CIFCl2 H12 Ni O6I 1 2/m 16.5628; 7.033; 8.7326
90; 96.723; 90		400.29Boeré, René T.
Crystal Structures of CuCl2·2H2O (Eriochalcite) and NiCl2∙6H2O (Nickelbischofite) at Low Temperature: Full Refinement of Hydrogen Atoms Using Non-Spherical Atomic Scattering Factors
Crystals, 2023, 13, 293
1568590 CIFCl2 H12 Ni O6I 1 2/m 16.5579; 7.0244; 8.7291
90; 96.702; 90		399.36Boeré, René T.
Crystal Structures of CuCl2·2H2O (Eriochalcite) and NiCl2∙6H2O (Nickelbischofite) at Low Temperature: Full Refinement of Hydrogen Atoms Using Non-Spherical Atomic Scattering Factors
Crystals, 2023, 13, 293
1571152 CIFC26 H42 Cl2 N2 Si2I 1 2/m 110.53; 10.929; 12.931
90; 96.525; 90		1478.5Hüßler, Christopher; Dietl, Martin C.; Kahle, Justin; Lopes, Eric F.; Kawamura, Miku; Krämer, Petra; Rominger, Frank; Rudolph, Matthias; Hachiya, Iwao; Hashmi, A Stephen K
Synthesis and structural properties of <i>para</i>-diselenopyrazines.
Chemical communications (Cambridge, England), 2024, 60, 3786-3789
1572374 CIFC2 H9 N3 O3 SI 1 2/m 110.0029; 7.3514; 10.4776
90; 102.8; 90		751.33Li, Yang; Chen, Xinglong; Ok, Kang Min
Strategically designed metal-free deep-ultraviolet birefringent crystals with superior optical properties.
Chemical science, 2024, 15, 15145-15151
1572636 CIFC240 H172 Cl8 N12I 1 2/m 120.1388; 53.4956; 31.8306
90; 106.792; 90		32830.1Stawski, Wojciech; Anderson, Harry L.
Polymorphism and flexibility of six-porphyrin nanorings in the solid state.
Chemical science, 2024, 15, 16938-16946
1572938 CIFC122 H113 B3 F12 N43 Pd2I 1 2/m 116.859; 23.453; 17.529
90; 90.35; 90		6931Virtue, Jemma I.; Tsoukatos, Steven; Johnston, Martin R.; Bloch, Witold M.
Halide-triggered assembly and selective bisulfate recognition in a quadruply interlocked coordination cage.
Chemical science, 2024, 15, 19119-19125
2004763 CIF
Paper		C12 H24 Hg I2 O6I 1 2/m 19.236; 11.236; 9.283
90; 90.44; 90		963.3El Essawi, M.; Abd El Khalik, S.; Tebbe, K.-F.
Verfeinerung von Quecksilberdiiodid-(18-Krone-6), Hg(18-krone-6)I~2~
Acta Crystallographica Section C, 1996, 52, 818-820
2011341 CIF
HKL
Paper		C16 H24 Cl2 N2 O4I 1 2/m 111.255; 6.865; 11.953
90; 104.15; 90		895.5Košutić-Hulita, Nada; Danilovski, Aleksandar; Malešević, Miroslav; Orešić, Marina; Dumić, Miljenko
2,8-Dihydroxy-1,3,7,9-tetramethyl-6,12-dihydrodipyrido[1,2-<i>a</i>:1',2'-<i>d</i>]pyrazinediylium dichloride dihydrate
Acta Crystallographica Section C, 2000, 56, 1144-1145
2014172 CIF
Paper		C16 H40 Cl6 N2 Pd2I 1 2/m 18.7249; 12.238; 13.062
90; 91.973; 90		1393.9Fábry, Jan; Dušek, Michal; Fejfarová, Karla; Krupková, Radmila; Vaněk, Přemysl; Němec, Ivan
Two phases of bis(tetraethylammonium) di-μ-chloro-bis[dichloropalladium(II)]
Acta Crystallographica Section C, 2004, 60, m426-m430
2020150 CIFGa10 Ge O20 Pb3I 1 2/m 114.751; 11.695; 5.106
90; 90.23; 90		880.844Cadee, M.C.; Verschoor, G.C.; Ijdo, D.J.W.
Structures of Pb3 Ge Ga10 O20 and Ba3 Sn Fe10 O20
Acta Crystallographica C (39,1983-), 1983, 39, 921-925
2020151 CIFBa3 Fe10 O20 SnI 1 2/m 115.443; 11.9068; 5.2473
90; 90.945; 90		964.725Cadee, M.C.; Verschoor, G.C.; Ijdo, D.J.W.
Structures of Pb3 Ge Ga10 O20 and Ba3 Sn Fe10 O20
Acta Crystallographica C (39,1983-), 1983, 39, 921-925
2020376 CIFPb4 S13 Sb6I 1 2/m 123.698; 3.98; 24.466
90; 93.9; 90		2302.24Skowron, A.; Brown, I.D.
Refinement of the structure of robinsonite, Pb4 Sb6 S13
Acta Crystallographica C (39,1983-), 1990, 46, 527-531
2100570 CIF
Paper		Ba Bi O3I 1 2/m 16.18505; 6.13219; 8.65846
90; 90.2288; 90		328.395Kennedy, Brendan J.; Howard, Christopher J.; Knight, Kevin S.; Zhang, Zhaoming; Zhou, Qingdi
Structures and phase transitions in the ordered double perovskites Ba~2~Bi^III^Bi^V^O~6~ and Ba~2~Bi^III^Sb^V^O~6~
Acta Crystallographica Section B, 2006, 62, 537-546
2100573 CIF
Paper		Ba2 Bi O6 SbI 1 2/m 16.06777; 6.01862; 8.50818
90; 90.2161; 90		310.713Kennedy, Brendan J.; Howard, Christopher J.; Knight, Kevin S.; Zhang, Zhaoming; Zhou, Qingdi
Structures and phase transitions in the ordered double perovskites Ba~2~Bi^III^Bi^V^O~6~ and Ba~2~Bi^III^Sb^V^O~6~
Acta Crystallographica Section B, 2006, 62, 537-546
2102519 CIF
Paper		C14 H24 Fe N2 O8I 1 2/m 111.78; 9.734; 8.401
90; 104.05; 90		934.5Prof. Clemente Dore Augusto; Prof. Marzotto Armando
30 Space-group corrections: two examples of false polymorphism and one of incorrect interpretation of the fine details of an IR spectrum
Acta Crystallographica Section B, 2004, 60, 287-292
2103798 CIF
Paper		C8 H12 S8 Tc2I 1 2/m 111.361; 8.303; 8.987
90; 95.25; 90		844.2Clemente, Dore Augusto; Marzotto, Armando
22 Space-group changes
Acta Crystallographica Section B, 2003, 59, 43-50
2104994 CIF
HKL
Paper		C10 H36 N2 Ni O19I 1 2/m 112.37; 12.57; 8.114
90; 101.48; 90		1236.4Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
[Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·2H~2~O: three phase transitions and an intermediate modulated phase stable over a range of <i>ca</i> 40K
Acta Crystallographica Section B, 2011, 67, 486-498
2105020 CIF
HKL
Paper		C10 H36 N2 Ni O19I 1 2/m 112.37; 12.57; 8.114
90; 101.48; 90		1236.4Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
[Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·2H~2~O: three phase transitions and an intermediate modulated phase stable over a range of <i>ca</i> 40K
Acta Crystallographica Section B, 2011, 67, 486-498
2105021 CIF
HKL
Paper		C10 H36 N2 Ni O19I 1 2/m 112.379; 12.558; 8.12
90; 101.68; 90		1236.2Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
[Ni(H~2~O)~6~](NO~3~)~2~·(15-crown-5)·2H~2~O: three phase transitions and an intermediate modulated phase stable over a range of <i>ca</i> 40K
Acta Crystallographica Section B, 2011, 67, 486-498
2105964 CIFC2 H2 Ca O5I 1 2/m 19.978; 7.295; 6.292
90; 107.07; 90		437.82Deganello, S
The Structure of Whewellite, CaC~2~O~4~ . H~2~O, at 328 K
Acta Crystallographica, Section B: Structural Crystallography and Crystal Chemistry, 1981, 37, 826-829
2106074 CIFAg3 H2 O10 P3I 1 2/m 19.326; 10.925; 9.276
90; 106.5; 90		906.18Baur, W.H.; Tillmanns, E.
How to avoid unneccessarily low symmetry in crystal structure determinations
Acta Crystallographica B (39,1983-), 1986, 42, 95-111
2106452 CIFBa2 Bi2 O6I 1 2/m 16.1736; 6.1237; 8.6507
90; 90.29; 90		327.038Thornton, G.; Jacobson, A.J.
A neutron diffraction determination of the structures of Ba2 Sb(V) Bi(III) O6 and Ba2 Bi(V) Bi(III) O6
Acta Crystallographica B (24,1968-38,1982), 1978, 34, 351-354
2106560 CIFBa0.159 Bi0.841 O2.5 TiI 1 2/m 110.6914; 3.7963; 3.3457
90; 92.625; 90		135.652Michiue, Y.; Yamamoto, A.; Onoda, M.; Yamane, H.; Akashi, T.; Sato, A.; Goto, T.
Incommensurate crystallographic shear structure of Ba(x) Bi(2-2x) Ti(4-x) O(11-4x) (x = 0.275)
Acta Crystallographica B (39,1983-), 2005, 61, 145-153
2107011 CIFS13 Sb6 Sn4I 1 2/m 124.31; 3.915; 23.49
90; 94.05; 90		2230.05Jumas, J.C.; Olivier-Fourcade, J.; Philippot, E.; Maurin, M.
Sur le systeme Sn S - Sb2 S3: Etude structurale de Sn4 Sb6 S13
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2940-2945
2107129 CIFC H4 Ca7 O23 Si6I 1 2/m 110.118; 15.187; 6.626
90; 100.4; 90		1001.44Pluth, J.J.; Smith, J.V.
The crystal structure of scawtite, Ca7 Si6 O18 C O3 (H2 O)2
Acta Crystallographica B (24,1968-38,1982), 1973, 29, 73-80
2107130 CIFAl0.2 Ba0.68 Fe1.3 H Mn6.5 O16.5 Pb0.3I 1 2/m 110.026; 2.8782; 9.729
90; 91.03; 90		280.703Post, J.E.; Buseck, P.R.; von Dreele, R.B.
Symmetry and Cation Displacements in Hollandites: Structure Refinements of Hollandite, Cryptomelane and Priderite
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1056-1065
2107227 CIFBa1.14 Mg1.14 O16 Ti6.86I 1 2/m 110.1816; 2.9733; 10.0268
90; 90.489; 90		303.53Cheary, R.W.; Squadrito, R.
A structural analysis of barium magnesium hollandites
Acta Crystallographica B (39,1983-), 1989, 45, 205-212
2107229 CIFBa1.33 Mg1.33 O16 Ti6.67I 1 2/m 110.2609; 2.98052; 9.9212
90; 91.072; 90		303.365Cheary, R.W.; Squadrito, R.
A structural analysis of barium magnesium hollandites
Acta Crystallographica B (39,1983-), 1989, 45, 205-212
2206238 CIF
Paper		C21 H14 N6I 1 2/m 111.46; 13.094; 13.563
90; 114.22; 90		1856Conway, Shane P.; Pratt, Albert C.; Long, Conor; Howie, R. Alan
Benzylammonium 2,4-bis(dicyanomethylene)-2,3-dihydroisoindolide
Acta Crystallographica Section E, 2005, 61, o2258-o2260
2206809 CIF
HKL
Paper		Au2 I6 Rb2I 1 2/m 18.725; 7.932; 11.969
90; 99.53; 90		816.9Matsushita, Nobuyuki; Tanaka, Atsushi; Kojima, Norimichi
A three-dimensional iodo-bridged mixed-valence gold(I,III) compound, Rb~2~[Au^I^I~2~][Au^III^I~4~]
Acta Crystallographica Section E, 2005, 61, i201-i203
2212533 CIF
HKL
Paper		C10 H10 Cl4 N2 PdI 1 2/m 16.718; 11.754; 8.015
90; 90.649; 90		632.9Valdés-Martínez, Jesús; Toscano, Rubén A.; Germán-Acacio, Juan Manuel
4,4'-Bipyridinium tetrachloridopalladate(II)
Acta Crystallographica Section E, 2007, 63, m870-m871
2240371 CIF
Paper		C8 H54 Mn2 N2 O43 V10I 1 2/m 113.2434; 9.6402; 17.7628
90; 98.626; 90		2242.1Franco, Maurício P.; Rüdiger, André Luis; Soares, Jaísa F.; Nunes, Giovana G.; Hughes, David L.
Crystal structures of two decavanadates(V) with pentaaquamanganese(II) pendant groups: (NMe~4~)~2~[V~10~O~28~{Mn(H~2~O)~5~}~2~]·5H~2~O and [NH~3~C(CH~2~OH)~3~]~2~[V~10~O~28~{Mn(H~2~O)~5~}~2~]·2H~2~O
Acta Crystallographica Section E, 2015, 71, 146-150
2310453 CIFCl2 H4 Ni O2I 1 2/m 16.9093; 6.8858; 8.8298
90; 92.246; 90		419.764Morosin, B.
An X-ray diffraction study on nickel(II) chloride dihydrate
Acta Crystallographica (1,1948-23,1967), 1967, 23, 630-634
2310780 CIF
Paper		Bi0.097 Fe1.049 O2.585 Pb0.856I 1 2/m 13.93492; 3.93193; 4.00171
90; 92.603; 90		61.85Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143
2310781 CIF
Paper		Bi0.195 Fe1.046 O2.633 Pb0.763I 1 2/m 13.92822; 3.92661; 4.05202
90; 92.209; 90		62.454Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143
2310782 CIF
Paper		Bi0.292 Fe1.042 O2.675 Pb0.671I 1 2/m 13.92131; 3.91951; 4.09255
90; 91.913; 90		62.866Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143
2310783 CIF
Paper		Bi0.428 Fe1.034 O2.736 Pb0.541I 1 2/m 13.9146; 3.91271; 4.13775
90; 91.554; 90		63.353Batuk, Dmitry; Batuk, Maria; Abakumov, Artem M.; Hadermann, Joke
Synergy between transmission electron microscopy and powder diffraction: application to modulated structures.
Acta Crystallographica, Section B: Structural Science, Crystal Engineering and Materials, 2015, 71, 127-143

Left arrow Left arrow First | Left arrow Previous 100 | of 4 | Next 100 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!
Top of the page
All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.