Crystallography Open Database

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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
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
2310784 CIF
Paper		Bi0.545 Fe1.027 O2.783 Pb0.428I 1 2/m 13.90908; 3.90585; 4.16564
90; 91.318; 90		63.585Batuk, 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
2310849 CIFAl0.11 Ca0.17 Fe2.14 H2 K0.13 Mg3.06 Na1.38 O24 Si7.94I 1 2/m 19.89; 17.95; 5.31
90; 72.5; 90		899.031Whittaker, E. J. W.
The structure of bolivian crocidolite
Acta Crystallographica, 1949, 2, 312-317
2312335 CIF
HKL
Paper		Fe H6 K3 O12 Te2I 1 2/m 112.8036; 14.9042; 5.9782
90; 90.002; 90		1140.8Wolflehner, Tobias; Stöger, Berthold
Order-disorder (OD) polytypism of K<sub>3</sub>FeTe<sub>2</sub>O<sub>8</sub>(OH)<sub>2</sub>(H<sub>2</sub>O)<sub>1+x</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 510-518
2312336 CIF
HKL		Fe H4.86 K3 O11.43 Te2I 1 2/m 112.766; 14.947; 5.9706
90; 90.047; 90		1139.27Wolflehner, Tobias; Stöger, Berthold
Order-disorder (OD) polytypism of K<sub>3</sub>FeTe<sub>2</sub>O<sub>8</sub>(OH)<sub>2</sub>(H<sub>2</sub>O)<sub>1+x</sub>.
Acta crystallographica Section B, Structural science, crystal engineering and materials, 2023, 79, 510-518
3000534 On hold until 2024-11-29Al8 Na7.62 O51.45 Si16I 1 2/m 118.2741; 13.7711; 11.9077
90; 102.754; 90		2922.69Georgia Cametti
To be published
3000535 On hold until 2024-11-29Al16 Na16.07 O96 Si32I 1 2/m 118.2506; 13.8793; 11.8929
90; 102.995; 90		2935.39Georgia Cametti
To be published
3000536 On hold until 2025-03-29Al8 Na7.93 O48 Si16I 1 2/m 118.2789; 13.8795; 11.9023
90; 102.89; 90		2943.54Georgia Cametti
To be published
3500059 CIF
HKL		O4 Pd SI 1 2/m 14.9466; 4.9481; 6.1943
90; 92.8096; 90		151.43Yvon Laligant; Armel Le Bail
Approaching the crystal structure of N-PdSO4 in the monoclinic subcell a/2, b/2, c/2 (see J. Alloys and Compounds 216, 1994, 11-19)
Personal communication to COD, 2016
4001088 CIFC20 H24 F16 N4 O4 Ta4I 1 2/m 19.0476; 15.897; 10.823
90; 92.327; 90		1555.4Alam, Todd M.; Clawson, Jacalyn S.; Bonhomme, François; Thoma, Steven G.; Rodriguez, Mark A.; Zheng, Shaohui; Autschbach, Jochen
A Solid-State NMR, X-ray Diffraction, and Ab Initio Investigation into the Structures of Novel Tantalum Oxyfluoride Clusters
Chemistry of Materials, 2008, 20, 2205
4001089 CIFC20 H24 F16 N4 O4 Ta4I 1 2/m 19.257; 15.918; 10.923
90; 92.915; 90		1607.5Alam, Todd M.; Clawson, Jacalyn S.; Bonhomme, François; Thoma, Steven G.; Rodriguez, Mark A.; Zheng, Shaohui; Autschbach, Jochen
A Solid-State NMR, X-ray Diffraction, and Ab Initio Investigation into the Structures of Novel Tantalum Oxyfluoride Clusters
Chemistry of Materials, 2008, 20, 2205
4002270 CIFCr Ni S4 VI 1 2/m 15.848; 3.34142; 11.0596
90; 91.907; 90		215.992Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002271 CIFCr0.8 Ni S4 V1.2I 1 2/m 15.8447; 3.3272; 11.0749
90; 91.971; 90		215.24Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002272 CIFCr0.6 Ni S4 V1.4I 1 2/m 15.8391; 3.31464; 11.065
90; 92.123; 90		214.011Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002273 CIFCr0.2 Ni S4 V1.8I 1 2/m 15.8376; 3.28741; 11.06386
90; 92.267; 90		212.156Vaqueiro, P.; Powell, A.V.; Bold, M.; Ritter, C.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002274 CIFCr1.9 Ni S4 V0.1I 1 2/m 15.8411; 3.3969; 11.011
90; 91.642; 90		218.387Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002275 CIFCr1.7 Ni S4 V0.3I 1 2/m 15.8422; 3.3836; 11.026
90; 91.654; 90		217.867Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002276 CIFCr1.6 Ni S4 V0.4I 1 2/m 15.8285; 3.3701; 11.004
90; 91.689; 90		216.054Vaqueiro, P.; Bold, M.; Ritter, C.; Powell, A.V.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002277 CIFCr1.5 Ni S4 V0.5I 1 2/m 15.825; 3.365; 10.999
90; 91.803; 90		215.486Vaqueiro, P.; Bold, M.; Powell, A.V.; Ritter, C.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002280 CIFCr0.976 S2 V0.524I 1 2/m 15.9449; 3.3834; 11.2263
90; 91.573; 90		225.72Vaqueiro, P.; Powell, A.V.
Structures and properties of new ordered defect phases in the vanadium chromium sulfide system
Chemistry of Materials (1,1989-), 2000, 12, 2705-2714
4002281 CIFCr0.941 S2 V0.578I 1 2/m 15.9461; 3.3773; 11.2353
90; 91.68; 90		225.528Vaqueiro, P.; Powell, A.V.
Structures and properties of new ordered defect phases in the vanadium chromium sulfide system
Chemistry of Materials (1,1989-), 2000, 12, 2705-2714
4002282 CIFCr0.963 S2 V0.606I 1 2/m 15.9536; 3.3942; 11.331
90; 91.31; 90		228.914Vaqueiro, P.; Powell, A.V.
Structures and properties of new ordered defect phases in the vanadium chromium sulfide system
Chemistry of Materials (1,1989-), 2000, 12, 2705-2714
4002283 CIFCr0.981 S2 V0.627I 1 2/m 15.9574; 3.4009; 11.3825
90; 91.127; 90		230.571Vaqueiro, P.; Powell, A.V.
Structures and properties of new ordered defect phases in the vanadium chromium sulfide system
Chemistry of Materials (1,1989-), 2000, 12, 2705-2714
4002284 CIFCr0.968 S2 V0.671I 1 2/m 15.9562; 3.40467; 11.412
90; 90.995; 90		231.388Vaqueiro, P.; Powell, A.V.
Structures and properties of new ordered defect phases in the vanadium chromium sulfide system
Chemistry of Materials (1,1989-), 2000, 12, 2705-2714
4002285 CIFCr0.969 S2 V0.735I 1 2/m 15.9511; 3.4163; 11.4716
90; 90.62; 90		233.212Vaqueiro, P.; Powell, A.V.
Structures and properties of new ordered defect phases in the vanadium chromium sulfide system
Chemistry of Materials (1,1989-), 2000, 12, 2705-2714
4002288 CIFCr1.4 Ni S4 V0.6I 1 2/m 15.8653; 3.3712; 11.061
90; 91.68; 90		218.616Vaqueiro, P.; Bold, M.; Ritter, C.; Powell, A.V.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002289 CIFCr1.2 Ni S4 V0.8I 1 2/m 15.8517; 3.35413; 11.0542
90; 91.834; 90		216.854Vaqueiro, P.; Bold, M.; Ritter, C.; Powell, A.V.
Structural, magnetic, and electronic properties of vanadium-substituted nickel chromium sulfide
Chemistry of Materials (1,1989-), 2000, 12, 1034-1041
4002590 CIFMn Na O2I 1 2/m 13.15603; 2.85523; 4.7799
90; 91.4521; 90		43.059Abakumov, Artem M.; Tsirlin, Alexander A.; Bakaimi, Ioanna; Van Tendeloo, Gustaaf; Lappas, Alexandros
Multiple Twinning As a Structure Directing Mechanism in Layered Rock-Salt-Type Oxides: NaMnO2Polymorphism, Redox Potentials, and Magnetism
Chemistry of Materials, 2014, 140509152558002
4030429 CIFC24 H72 Cu4 N4 Si8I 1 2/m 19.3805; 13.561; 17.799
90; 90.065; 90		2264.2Miele, P.; Foulon, J.D.; Hovnanian, N.; Durand, J.; Cot, L.
Synthesis and crystal structure of a volatile molecular precursor of copper: [CuN(SiMe3)2]4
European Journal of Solid State and Inorganic Chemistry, 1992, 29, 573-583
4030511 CIFBa2 Bi1.33 O6 Ru0.67I 1 2/m 16.0356; 6.048; 8.5556
90; 90.314; 90		312.3Darriet, J.; Bontchev, R.; Dussarrat, C.; Weill, F.; Darriet, B.
The system BaRuO3-BaBiO3. I. Crystal structures of BaRu2BiO9 and Ba2RuxBi2-xO6 (0<x<=0.67)
European Journal of Solid State and Inorganic Chemistry, 1993, 30, 273-286
4030844 CIFF12 Th Zr2I 1 2/m 19.895; 10.488; 7.856
90; 90.73; 90		815.2Taoudi, A.; Mikou, A.; Laval, J. P.
Synthesis ans characterization of two new ordered crystallines phases close to ThF4-ZrF4 fluoride glasses. II: Crystal structure of ThZr2F12
European Journal of Solid State and Inorganic Chemistry, 1996, 33, 1051-1062
4037086 CIFC16 H17 Br O4I 1 2/m 19.1684; 7.1253; 22.658
90; 92.64; 90		1478.6Geibel, Irina; Dierks, Anna; Schmidtmann, Marc; Christoffers, Jens
Formation of δ-Lactones by Cerium-Catalyzed, Baeyer-Villiger-Type Coupling of β-Oxoesters, Enol Acetates, and Dioxygen.
The Journal of organic chemistry, 2016, 81, 7790-7798
4037919 CIFC8 H13 N O4I 1 2/m 15.6345; 6.4841; 25.9775
90; 95.661; 90		944.45Nikahd, Maryam; Mikusek, Jiri; Yu, Li-Juan; Coote, Michelle L.; Banwell, Martin G.; Ma, Chenxi; Gardiner, Michael G.
Exploiting Chitin as a Source of Biologically Fixed Nitrogen: Formation and Full Characterization of Small-Molecule Hetero- and Carbocyclic Pyrolysis Products.
The Journal of organic chemistry, 2020
4064287 CIFC43 H47 O10 Pd2 Te4I 1 2/m 17.8457; 15.1119; 19.1215
90; 91.798; 90		2265.99Chakraborty, Tapash; Sharma, Sagar; Singh, Harkesh B.; Butcher, Ray J.
Reactions of Di-o-tolyl Telluride and Selenide with Palladium Acetate: Isolation of a Novel Palladium Complex of a Tellurenic Acid Anhydride and Related Trinuclear and Tetranuclear Palladium Complexes
Organometallics, 2011, 30, 2525
4065657 CIFC66 H92 Fe2 N2I 1 2/m 111.963; 20.35; 12.583
90; 99.002; 90		3025.6Ni, Chengbao; Lei, Hao; Power, Philip P.
Reaction of M(II) Diaryls (M = Mn or Fe) with Ammonia to Afford Parent Amido Complexes
Organometallics, 2010, 29, 1988
4073304 CIFC20 H46 B4 Hg N4I 1 2/m 116.0954; 15.2954; 11.3501
90; 101.249; 90		2740.6Ly, Hanh V.; Forster, Taryn D.; Parvez, Masood; McDonald, Robert; Roesler, Roland
Zinc, Cadmium, and Mercury Metallocenes Incorporating 1,2-Diaza-3,5-diborolyl Ligands
Organometallics, 2007, 26, 3516
4088849 CIFC47 H46 Ag B Cl8 F4 N2I 1 2/m 111.982; 23.133; 17.482
90; 94.631; 90		4830Klimovica, Kristine; Kirschbaum, Kristin; Daugulis, Olafs
Synthesis and Properties of "Sandwich" Diimine-Coinage Metal Ethylene Complexes.
Organometallics, 2016, 35, 2938-2943
4115385 CIFC84 H210 Cu26 P14 Se13I 1 2/m 117.2391; 23.4906; 17.303
90; 90.305; 90		7006.9Nathan R. M. Crawford; Allan G. Hee; Jeffrey R. Long
Cluster Synthesis via Ligand-Arrested Solid Growth: Triethylphosphine-Capped Fragments of Binary Metal Chalcogenides
Journal of the American Chemical Society, 2002, 124, 14842-14843
4115569 CIFO64 Si32I 1 2/m 118.6794; 13.5313; 7.6028
90; 102.196; 90		1878.3Luis A. Villaescusa; Philip Lightfoot; Simon J. Teat; Russell E. Morris
Variable-Temperature Microcrystal X-ray Diffraction Studies of Negative Thermal Expansion in the Pure Silica Zeolite IFR
Journal of the American Chemical Society, 2001, 123, 5453-5459
4115570 CIFO64 Si32I 1 2/m 118.6504; 13.4868; 7.6257
90; 101.99; 90		1876.3Luis A. Villaescusa; Philip Lightfoot; Simon J. Teat; Russell E. Morris
Variable-Temperature Microcrystal X-ray Diffraction Studies of Negative Thermal Expansion in the Pure Silica Zeolite IFR
Journal of the American Chemical Society, 2001, 123, 5453-5459
4115571 CIFO64 Si32I 1 2/m 118.6277; 13.4777; 7.6305
90; 101.927; 90		1874.3Luis A. Villaescusa; Philip Lightfoot; Simon J. Teat; Russell E. Morris
Variable-Temperature Microcrystal X-ray Diffraction Studies of Negative Thermal Expansion in the Pure Silica Zeolite IFR
Journal of the American Chemical Society, 2001, 123, 5453-5459
4116100 CIFC76 H110 Al14 Cl SiI 1 2/m 113.43; 18.333; 17.118
90; 94.86; 90		4199.5Andreas Purath; Carsten Dohmeier; Achim Ecker; Ralf Köppe; Harald Krautscheid; Hansgeorg Schnöckel; Reinhart Ahlrichs; Carsten Stoermer; Jochen Friedrich; Peter Jutzi
Synthesis and Structure of a Neutral SiAl14 Cluster
Journal of the American Chemical Society, 2000, 122, 6955-6959
4117376 CIFC5 F N2 O24 Si12I 1 2/m 110.42128; 14.8998; 17.5897
90; 105.807; 90		2627.96Alex Rojas; Evangelina Martínez-Morales; Claudio M. Zicovich-Wilson; Miguel A. Camblor
Zeolite Synthesis in Fluoride Media: Structure Direction toward ITW by Small Methylimidazolium Cations
Journal of the American Chemical Society, 2012, 134, 2255-2263
4117377 CIFC6 F N2 O24 Si12I 1 2/m 110.43748; 14.80768; 17.50255
90; 106.09; 90		2599.15Alex Rojas; Evangelina Martínez-Morales; Claudio M. Zicovich-Wilson; Miguel A. Camblor
Zeolite Synthesis in Fluoride Media: Structure Direction toward ITW by Small Methylimidazolium Cations
Journal of the American Chemical Society, 2012, 134, 2255-2263
4117378 CIFO2 SiI 1 2/m 110.32658; 14.9994; 17.71021
90; 105.396; 90		2644.74Alex Rojas; Evangelina Martínez-Morales; Claudio M. Zicovich-Wilson; Miguel A. Camblor
Zeolite Synthesis in Fluoride Media: Structure Direction toward ITW by Small Methylimidazolium Cations
Journal of the American Chemical Society, 2012, 134, 2255-2263
4123551 CIFC18 H48 N18 O18 S6I 1 2/m 110.013; 21.303; 10.071
90; 103.21; 90		2091.4Liu, Yuzhou; Xiao, Wenchang; Yi, Jin Ju; Hu, Chunhua; Park, Sang-Jae; Ward, Michael D.
Regulating the Architectures of Hydrogen-Bonded Frameworks through Topological Enforcement.
Journal of the American Chemical Society, 2015, 137, 3386-3392
4125252 CIFC72 H112 F2 Mg2 N4 O2I 1 2/m 111.9516; 18.2934; 15.7645
90; 99.934; 90		3395Bakewell, Clare; White, Andrew J. P.; Crimmin, Mark R.
Addition of Carbon-Fluorine Bonds to a Mg(I)-Mg(I) Bond: An Equivalent of Grignard Formation in Solution.
Journal of the American Chemical Society, 2016, 138, 12763-12766
4126753 CIFC0.5 H6 Mn0.5 N1.5 O3 P1.5I 1 2/m 18.7596; 13.2087; 9.6956
90; 89.764; 90		1121.8Wu, Yue; Shaker, Sammy; Brivio, Federico; Murugavel, Ramaswamy; Bristowe, Paul D.; Cheetham, Anthony K.
[Am]Mn(H2POO)3: A New Family of Hybrid Perovskites Based on the Hypophosphite Ligand.
Journal of the American Chemical Society, 2017
4130430 CIFC76 H61 Cl4 F6 Fe2 N11 O22I 1 2/m 111.655; 26.4005; 28.4632
90; 91.2677; 90		8755.9Sahu, Sumit; Zhang, Bo; Pollock, Christopher J.; Dürr, Maximilian; Davies, Casey G.; Confer, Alex M.; Ivanović-Burmazović, Ivana; Siegler, Maxime A.; Jameson, Guy N. L.; Krebs, Carsten; Goldberg, David P.
Aromatic C-F Hydroxylation by Nonheme Iron(IV)-Oxo Complexes: Structural, Spectroscopic, and Mechanistic Investigations.
Journal of the American Chemical Society, 2016, 138, 12791-12802
4132050 CIFC2 H10 I2 N2I 1 2/m 115.54; 5.0795; 5.0964
90; 96.032; 90		400.06Spanopoulos, Ioannis; Ke, Weijun; Stoumpos, Constantinos C.; Schueller, Emily C.; Kontsevoi, Oleg Y.; Seshadri, Ram; Kanatzidis, Mercouri G.
Unraveling the Chemical Nature of the 3D "Hollow" Hybrid Halide Perovskites.
Journal of the American Chemical Society, 2018, 140, 5728-5742
4133018 CIFC6 Ag5 S6I 1 2/m 115.1318; 9.1148; 4.2826
90; 110.435; 90		553.5Huang, Xing; Li, Haisheng; Tu, Zeyi; Liu, Liyao; Wu, Xiaoyu; Chen, Jie; Liang, Yingying; Zou, Ye; Yi, Yuanping; Sun, Junliang; Xu, Wei; Zhu, Daoben
Highly Conducting Neutral Coordination Polymer with Infinite Two-Dimensional Silver-Sulfur Networks.
Journal of the American Chemical Society, 2018, 140, 15153-15156
4133410 CIFC352 H180 Co12 P12 Te16I 1 2/m 125.7743; 16.3541; 28.9052
90; 92.161; 90		12175.3O'Brien, Evan S; Russell, Jake C.; Bartnof, Matthew; Christodoulides, Alexander D.; Lee, Kihong; DeGayner, Jordan A.; Paley, Daniel W.; McGaughey, Alan J. H.; Ong, Wee-Liat; Malen, Jonathan A.; Zhu, X.-Y.; Roy, Xavier
Spontaneous Electronic Band Formation and Switchable Behaviors in a Phase-Rich Superatomic Crystal.
Journal of the American Chemical Society, 2018, 140, 15601-15605
4133695 CIFC72 H66 F9 In N6 Na0.5 O6 P1.5I 1 2/m 113.7314; 32.7897; 16.3067
90; 96.0838; 90		7300.7Arnold, Amela; Sherbow, Tobias J.; Sayler, Richard I.; Britt, R. David; Thompson, Emily J.; Muñoz, M Teresa; Fettinger, James C.; Berben, Louise A.
Organic Electron Delocalization Modulated by Ligand Charge States in [L<sub>2</sub>M]<sup> <i>n-</i> </sup> Complexes of Group 13 Ions.
Journal of the American Chemical Society, 2019, 141, 15792-15803
4300035 CIFC20 H22 F6 N6 O6 Pd2 S2I 1 2/m 19.368; 16.191; 20.228
90; 101.26; 90		3009.1Felipe Gómez-de la Torre; Antonio de la Hoz; Félix A. Jalón; Blanca R. Manzano; Ana M. Rodríguez; José Elguero; Martín Martínez-Ripoll
Pd(II) Complexes with Polydentate Nitrogen Ligands. Molecular Recognition and Dynamic Behavior Involving Pd-N Bond Rupture. X-ray Molecular Structures of [{Pd(C~6~HF~4~)~2~}(bpzm)] and [{PdΜ^3^-(C~4~H~7~)}~2~(bpzm)]CF~3~SO~3~)~2~ [bpzpm = 4,6-Bis(pyrazol-1-yl)pyrimidine]
Inorganic Chemistry, 2000, 39, 1152-1162
4300877 CIFC24 H20 N2 O Ru0.5 SI 1 2/m 114.629; 9.356; 14.465
90; 91.12; 90		1979.4Emma Gallo; Alessandro Caselli; Fabio Ragaini; Simone Fantauzzi; Norberto Masciocchi; Angelo Sironi; Sergio Cenini
Structural Determination of Ruthenium-Porphyrin Complexes Relevant to Catalytic Epoxidation of Olefins
Inorganic Chemistry, 2005, 44, 2039-2049
4301885 CIFC38.5 H36 Co4 N14 O14.5I 1 2/m 111.329; 13.9776; 15.11
90; 100.278; 90		2354.31Anastasia N. Georgopoulou; Catherine P. Raptopoulou; Vassilis Psycharis; Rafael Ballesteros; Belén Abarca; Athanassios K. Boudalis
Ferromagnetic CuII4, CoII4, and NiII6 Azido Complexes Derived from Metal-Assisted Methanolysis of Di-2,6-(2-pyridylcarbonyl)pyridine
Inorganic Chemistry, 2009, 48, 3167-3176
4304401 CIFC10 H8 Cl N2 O3 TcI 1 2/m 17.52742; 11.73765; 12.86694
90; 96.2859; 90		1130.01Yuji Tooyama; Henrik Braband; Bernhard Spingler; Ulrich Abram; Roger Alberto
High-Valent Technetium Complexes with the [99TcO3]+ Core from in Situ Prepared Mixed Anhydrides of [99TcO4]- and Their Reactivities
Inorganic Chemistry, 2008, 47, 257-264
4304402 CIFC12 H8 Cl N2 O3 TcI 1 2/m 17.5144; 11.616; 13.9303
90; 97.2381; 90		1206.25Yuji Tooyama; Henrik Braband; Bernhard Spingler; Ulrich Abram; Roger Alberto
High-Valent Technetium Complexes with the [99TcO3]+ Core from in Situ Prepared Mixed Anhydrides of [99TcO4]- and Their Reactivities
Inorganic Chemistry, 2008, 47, 257-264
4307641 CIFC64 H60 Cl10 N12 O2 Zn4I 1 2/m 111.7529; 27.09; 12.0596
90; 106.345; 90		3684.4Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie
Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks
Inorganic Chemistry, 2007, 46, 2224-2236
4307643 CIFC66 H63 Cl10 Cu4 N13 O2 Zn2I 1 2/m 111.869; 27.292; 12.241
90; 105.34; 90		3823.9Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie
Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks
Inorganic Chemistry, 2007, 46, 2224-2236
4307644 CIFC64 H60 Cl4 Cu4 N12 O2I 1 2/m 111.869; 27.292; 12.241
90; 105.34; 90		3823.9Frank B. Johansson; Andrew D. Bond; Christine J. McKenzie
Functional Tetrametallic Linker Modules for Coordination Polymers and Metal-Organic Frameworks
Inorganic Chemistry, 2007, 46, 2224-2236
4310992 CIFC24 H83 N6 O32.5 V5I 1 2/m 113.72; 14.309; 14.43
90; 108.4; 90		2688.1Bernd Morgenstern; Stefan Steinhauser; Kaspar Hegetschweiler; Eugenio Garribba; Giovanni Micera; Daniele Sanna; László Nagy
Complex Formation of Vanadium(IV) with 1,3,5-Triamino-1,3,5-trideoxy-cis-inositol and Related Ligands
Inorganic Chemistry, 2004, 43, 3116-3126
4311789 CIFC10 H40 Cl6 Co2 Hg5 N22 O2I 1 2/m 18.5648; 12.8938; 19.012
90; 97.088; 90		2083.5Neil D. Draper; Raymond J. Batchelor; Pedro M. Aguiar; Scott Kroeker; Daniel B. Leznoff
Factors Affecting the Solid-State Structure and Dimensionality of Mercury Cyanide/Chloride Double Salts, and NMR Characterization of Coordination Geometries
Inorganic Chemistry, 2004, 43, 6557-6567
4315190 CIFCd Cl1.75 O3.125 Sb2I 1 2/m 114.251; 3.9895; 21.145
90; 97.35; 90		1192.3Vinna Jo; Min Kyung Kim; Dong Woo Lee; Il-Wun Shim; Kang Min Ok
Lone Pairs as Chemical Scissors in New Antimony Oxychlorides, Sb2ZnO3Cl2 and Sb16Cd8O25Cl14
Inorganic Chemistry, 2010, 49, 2990-2995
4316523 CIFC66 H88 Ge2 P2I 1 2/m 112.0005; 19.9995; 12.7349
90; 98.979; 90		3019W. Alexander Merrill; Eric Rivard; Jeffrey S. DeRopp; Xinping Wang; Bobby D. Ellis; James C. Fettinger; Bernd Wrackmeyer; Philip P. Power
Synthesis and Characterization of the M(II) (M = Ge, Sn, or Pb) Phosphinidene Dimers {M(μ-PAr')}2 (Ar' = C6H3-2,6-(C6H3-2,6-Pri2)2)
Inorganic Chemistry, 2010, 49, 8481-8486
4316525 CIFC66 H88 P2 Pb2I 1 2/m 111.842; 20.591; 12.734
90; 98.436; 90		3071.4W. Alexander Merrill; Eric Rivard; Jeffrey S. DeRopp; Xinping Wang; Bobby D. Ellis; James C. Fettinger; Bernd Wrackmeyer; Philip P. Power
Synthesis and Characterization of the M(II) (M = Ge, Sn, or Pb) Phosphinidene Dimers {M(μ-PAr')}2 (Ar' = C6H3-2,6-(C6H3-2,6-Pri2)2)
Inorganic Chemistry, 2010, 49, 8481-8486
4316888 CIFCl2 H26 Mg10 O22I 1 2/m 122.28316; 3.13501; 8.13157
90; 97.7533; 90		562.862Robert E. Dinnebier; Daniela Freyer; Sebastian Bette; Melanie Oestreich
9Mg(OH)2.MgCl2.4H2O, a High Temperature Phase of the Magnesia Binder System
Inorganic Chemistry, 2010, 49, 9770-9776
4317971 CIFC6 H18 Au Cl N4 OI 1 2/m 19.25; 11.3768; 11.3137
90; 99.228; 90		1175.19Rochelle L. White-Morris; Marilyn M. Olmstead; Feilong Jiang; Alan L. Balch
New Insights into the Effects of Self-Association of the Cation [Au{C(NHMe)2}2]+ on Its Solid State Structure and Luminescence
Inorganic Chemistry, 2002, 41, 2313-2315
4317972 CIFC6 H18 Au Br N4 OI 1 2/m 19.3997; 11.4229; 11.5291
90; 101.013; 90		1215.1Rochelle L. White-Morris; Marilyn M. Olmstead; Feilong Jiang; Alan L. Balch
New Insights into the Effects of Self-Association of the Cation [Au{C(NHMe)2}2]+ on Its Solid State Structure and Luminescence
Inorganic Chemistry, 2002, 41, 2313-2315
4321367 CIFC18 H130 B6 N14 O97 P12 Sr2 V12I 1 2/m 115.7618; 16.4821; 21.1124
90; 107.473; 90		5231.7Junghwan Do; Ranko P. Bontchev; Allan J. Jacobson
Influence of Hydrogen Bonding on the Assembly of Six-Membered Vanadium Borophosphate Cluster Anions: Synthesis and Structures of (NH~4~)~2~(C~2~H~10~N~2~)~6~[Sr(H~2~O)~5~]~2~[V~2~P~2~BO~12~ ]~6~10H~2~O, (NH~4~)~2~(C~3~H~12~N~2~)~6~[Sr(H~2~O)~4~]~2~ [V~2~P~2~BO~12~]~6~17H~2~O, (NH~4~)~3~(C~2~H~10~N~2~)~4.5~ [Sr(H~2~O)~5~]~2~[Sr(H~2~O)~4~][V~2~P~2~BO~12~]~6~10H~2~O
Inorganic Chemistry, 2000, 39, 4305-4310
4321906 CIFC52 H51 Cl4 Fe2 N13 O17I 1 2/m 111.73; 18.64; 13.331
90; 93.74; 90		2908.6Gerard Roelfes; Marcel Lubben; Kui Chen; Raymond Y. N. Ho; Auke Meetsma; Susan Genseberger; Roel M. Hermant; Ronald Hage; Sanjay K. Mandal; Victor G. Young,; Yan Zang; Huub Kooijman; Anthony L. Spek; Lawrence Que,; Ben L. Feringa
Iron Chemistry of a Pentadentate Ligand That Generates a Metastable FeIII-OOH Intermediate
Inorganic Chemistry, 1999, 38, 1929-1936
4328470 CIFC82 H90 N8 O TiI 1 2/m 113.2868; 18.8506; 14.4279
90; 111.031; 90		3373Elisabeth Seikel; Benjamin Oelkers; Jörg Sundermeyer
Axial Functionalization of Sterically Hindered Titanium Phthalocyanines
Inorganic Chemistry, 2012, 51, 2709-2717
4330136 CIFCo3 Fe3 H12 O24 Pr2 Sr6I 1 2/m 13.8442; 3.8492; 35.811
90; 88.809; 90		529.78Laurent Jantsky; Hiroshi Okamoto; Antoine Demont; Helmer Fjellvåg
Tuning of Water and Hydroxide Content of Intercalated Ruddlesden-Popper-type Oxides in the PrSr3Co1.5Fe1.5O10-δSystem
Inorganic Chemistry, 2012, 51, 9181-9191
4333046 CIFC18 H57 La2 N4 O30 P5 SI 1 2/m 114.4085; 18.9382; 17.0522
90; 101.696; 90		4556.44Du, Zi-Yi; Xu, Hai-Bing; Mao, Jiang-Gao
Rational Design of 0D, 1D, and 3D Open Frameworks Based on Tetranuclear Lanthanide(III) Sulfonate−Phosphonate Clusters
Inorganic Chemistry, 2006, 45, 9780-9788
4333047 CIFC18 H57 N4 Nd2 O30 P5 SI 1 2/m 114.303; 18.7159; 17.0511
90; 102.118; 90		4462.8Du, Zi-Yi; Xu, Hai-Bing; Mao, Jiang-Gao
Rational Design of 0D, 1D, and 3D Open Frameworks Based on Tetranuclear Lanthanide(III) Sulfonate−Phosphonate Clusters
Inorganic Chemistry, 2006, 45, 9780-9788
4337674 CIFC18 H10 Cu2 F4 N6I 1 2/m 110.0785; 7.5317; 12.8559
90; 110.743; 90		912.61Le, Thanh H.; Nafady, Ayman; Vo, Nguyen T.; Elliott, Robert W.; Hudson, Timothy A.; Robson, Richard; Abrahams, Brendan F.; Martin, Lisandra L.; Bond, Alan M.
Electrochemically Directed Synthesis of Cu2(I)(TCNQF4(II-))(MeCN)2 (TCNQF4 = 2,3,5,6-Tetrafluoro-7,7,8,8-tetracyanoquinodimethane): Voltammetry, Simulations, Bulk Electrolysis, Spectroscopy, Photoactivity, and X-ray Crystal Structure of the Cu2(I)(TCNQF4(II-))(EtCN)2 Analogue.
Inorganic chemistry, 2014, 53, 3230-3242
4341616 CIFBa Te4 ThI 1 2/m 110.46; 6.38; 12.58
90; 91.54; 90		839.2Prakash, Jai; Lebègue, Sébastien; Malliakas, Christos D.; Ibers, James A.
Syntheses, Crystal Structures, Resistivity Studies, and Electronic Properties of Three New Barium Actinide Tellurides: BaThTe4, BaUTe4, and BaUTe6.
Inorganic chemistry, 2014, 141111074323002
4341617 CIFBa Te4 UI 1 2/m 110.363; 6.3037; 12.458
90; 91.26; 90		813.6Prakash, Jai; Lebègue, Sébastien; Malliakas, Christos D.; Ibers, James A.
Syntheses, Crystal Structures, Resistivity Studies, and Electronic Properties of Three New Barium Actinide Tellurides: BaThTe4, BaUTe4, and BaUTe6.
Inorganic chemistry, 2014, 141111074323002
4343509 CIFNb2 O7 TiI 1 2/m 117.6719; 3.8006; 11.8924
90; 95.295; 90		795.33Perfler, Lukas; Kahlenberg, Volker; Wikete, Christoph; Schmidmair, Daniela; Tribus, Martina; Kaindl, Reinhard
Nanoindentation, High-Temperature Behavior, and Crystallographic/Spectroscopic Characterization of the High-Refractive-Index Materials TiTa2O7 and TiNb2O7.
Inorganic chemistry, 2015, 54, 6836-6848
4343510 CIFO7 Ta2 TiI 1 2/m 117.6624; 3.8012; 11.829
90; 95.135; 90		790.99Perfler, Lukas; Kahlenberg, Volker; Wikete, Christoph; Schmidmair, Daniela; Tribus, Martina; Kaindl, Reinhard
Nanoindentation, High-Temperature Behavior, and Crystallographic/Spectroscopic Characterization of the High-Refractive-Index Materials TiTa2O7 and TiNb2O7.
Inorganic chemistry, 2015, 54, 6836-6848
4343693 CIFCl4 NbI 1 2/m 18.14; 6.823; 8.852
90; 91.92; 90		491.357Taylor, D.R.; Calabrese, J.C.; Larsen, E.M.
Crystal structure of niobium tetrachloride
Inorganic Chemistry, 1977, 16, 721-722
4343752 CIFC15 H O15 Os3 ReI 1 2/m 110.557; 10.481; 10.144
90; 102.14; 90		1097.31Churchill, M.R.; Hollander, F.J.
Structural studies on polynuclear osmium carbonyl hydrides. 4. Crystal structure and molecular geometry of H Os3 Re (C O)15 , a rhomboidal metal cluster species
Inorganic Chemistry, 1977, 16, 2493-2497
4344308 CIFCl36 Zr12I 1 2/m 122.216; 13.323; 6.6236
90; 90.15; 90		1960.47Kleppinger, J.; Wrazel, J.; Calabrese, J.C.; Larsen, E.M.
Preparation and Structure of a Reduced-State Zirconium Cluster Containing Triangular (Zr3 Cl6) Units
Inorganic Chemistry, 1980, 19, 3172-3175
4345475 CIFC12 H14 Cu N2 O10 SI 1 2/m 111.728; 6.853; 20.166
90; 92.328; 90		1619.4Maity, Dilip Kumar; Otake, Kenichi; Ghosh, Saheli; Kitagawa, Hiroshi; Ghoshal, Debajyoti
Sulfonic Group Functionalized Mixed Ligand Coordination Polymers: Synthesis, Characterization, Water Sorption, and Proton Conduction Studies.
Inorganic chemistry, 2017, 56, 1581-1590
4345882 CIFC64 H52 Mn6 N16 O22I 1 2/m 112.333; 30.364; 26.7615
90; 101.072; 90		9835.1Savva, Maria; Skordi, Katerina; Fournet, Adeline D.; Thuijs, Annaliese E.; Christou, George; Perlepes, Spyros P.; Papatriantafyllopoulou, Constantina; Tasiopoulos, Anastasios J.
Heterometallic Mn(III)4Ln2 (Ln = Dy, Gd, Tb) Cross-Shaped Clusters and Their Homometallic Mn(III)4Mn(II)2 Analogues.
Inorganic chemistry, 2017, 56, 5657-5668
4346017 CIFC43 H51 N4 O24 Zn2I 1 2/m 111.3404; 29.1741; 14.8727
90; 92.023; 90		4917.51Tan, Bin; Chen, Cheng; Cai, Li-Xuan; Zhang, Ya-Jun; Huang, Xiao-Ying; Zhang, Jie
Introduction of lewis acidic and redox-active sites into a porous framework for ammonia capture with visual color response.
Inorganic chemistry, 2015, 54, 3456-3461
4349519 CIFC39 H25 Cu3 N6 O13I 1 2/m 113.657; 18.686; 31.503
90; 101.532; 90		7877Kourtellaris, Andreas; Moushi, Eleni E.; Spanopoulos, Ioannis; Tampaxis, Christos; Charalambopoulou, Georgia; Steriotis, Theodore A.; Papaefstathiou, Giannis S.; Trikalitis, Pantelis N.; Tasiopoulos, Anastasios J.
A microporous Cu2+MOF based on a pyridyl isophthalic acid Schiff base ligand with high CO2uptake
Inorganic Chemistry Frontiers, 2016, 3, 1527
4349747 CIFC24 H132 Cu6 N24 Nb12 O60 Si V2I 1 2/m 114.8976; 20.6011; 16.2057
90; 96.757; 90		4939.1Zhang, Ting-Ting; Zhang, Xiao; Lü, Ying; Li, Guo-Dong; Xiao, Li-Na; Cui, Xiao-Bing; Xu, Ji-Qing
New organic‒inorganic hybrid compounds based on [SiNb12V2O42]12− with high catalytic activity for styrene epoxidation
Inorganic Chemistry Frontiers, 2017, 4, 1397
4502557 CIFC10 H12 Ag F4 N2 Nb O3I 1 2/m 13.8103; 16.7026; 22.2523
90; 90.021; 90		1416.18Lin, Haisheng; Maggard, Paul A.
Microporosity, Optical Bandgap Sizes, and Photocatalytic Activity of M(I)-Nb(V) (M = Cu, Ag) Oxyfluoride Hybrids
Crystal Growth & Design, 2010, 10, 1323
4504594 CIFC10 H10 Cl4 N2 PtI 1 2/m 16.6548; 11.695; 8.146
90; 91.32; 90		633.8Adams, Christopher J.; Angeloni, Alessandro; Orpen, A. Guy; Podesta, Thomas J.; Shore, Benjamin
Crystal Synthesis of Organic−Inorganic Hybrid Salts Based on Tetrachloroplatinate and -palladate Salts of Organic Cations: Formation of Linear, Two-, and Three-Dimensional NH···Cl Hydrogen Bond Networks
Crystal Growth & Design, 2006, 6, 411
4505763 CIFC44 H46 N4I 1 2/m 18.6155; 15.7605; 13.1152
90; 104.238; 90		1726.14Bond, Andrew D.; Feeder, Neil; Redman, James E.; Teat, Simon J.; Sanders, Jeremy K. M.
Molecular Conformation and Intermolecular Interactions in the Crystal Structures of Free-Base 5,15-Diarylporphyrins
Crystal Growth & Design, 2002, 2, 27
4508922 CIFC22 H18 Br2 N2 O8I 1 2/m 13.8623; 9.206; 30.164
90; 92.688; 90		1071.3Eppel, Sagi; Bernstein, Joel
Statistics-Based Design of Multicomponent Molecular Crystals with the Three-Center Hydrogen Bond
Crystal Growth & Design, 2009, 9, 1683
4513163 CIFC30 H32 Br2 Cu2 N6 O2 S2I 1 2/m 116.446; 7.763; 13.69
90; 94.214; 90		1743.1Abrahams, Brendan F.; Elliott, Robert W.; Hudson, Timothy A.; Robson, Richard; Sutton, Ashley L.
New CuI2(TCNQ‒II) and CuI2(F4TCNQ‒II) Coordination Polymers
Crystal Growth & Design, 2015, 15, 2437
4514514 CIFC44 H26 O8I 1 2/m 13.7703; 27.5034; 29.3675
90; 92.841; 90		3041.6Yin, Qi; Li, Yu-Lin; Li, Lan; Lü, Jian; Liu, Tian-Fu; Cao, Rong
Novel Hierarchical Meso-Microporous Hydrogen-Bonded Organic Framework for Selective Separation of Acetylene and Ethylene versus Methane.
ACS applied materials & interfaces, 2019, 11, 17823-17827
4514920 CIFCl5 H24 N9 O2 Ru2I 1 2/m 18.5277; 7.6795; 13.5715
90; 91.593; 90		888.433Woods, Joshua J.; Nemani, Neeharika; Shanmughapriya, Santhanam; Kumar, Akshay; Zhang, MengQi; Nathan, Sarah R.; Thomas, Manfred; Carvalho, Edmund; Ramachandran, Karthik; Srikantan, Subramanya; Stathopulos, Peter B.; Wilson, Justin J.; Madesh, Muniswamy
A Selective and Cell-Permeable Mitochondrial Calcium Uniporter (MCU) Inhibitor Preserves Mitochondrial Bioenergetics after Hypoxia/Reoxygenation Injury.
ACS central science, 2019, 5, 153-166
7002168 CIFC52 H52 Cl3 Mn3 N8 O18I 1 2/m 111.897; 22.067; 13.312
90; 93.82; 90		3487Prescimone, Alessandro; Sanchez-Benitez, Javier; Kamenev, Konstantin V.; Moggach, Stephen A.; Lennie, Alistair R.; Warren, John E.; Murrie, Mark; Parsons, Simon; Brechin, Euan K.
High pressure effects on a trimetallic MnII/III SMM
Dalton Transactions, 2009, 7390-7395
7002169 CIFC52 H52 Cl3 Mn3 N8 O18I 1 2/m 111.549; 21.72; 12.991
90; 94.04; 90		3250.6Prescimone, Alessandro; Sanchez-Benitez, Javier; Kamenev, Konstantin V.; Moggach, Stephen A.; Lennie, Alistair R.; Warren, John E.; Murrie, Mark; Parsons, Simon; Brechin, Euan K.
High pressure effects on a trimetallic MnII/III SMM
Dalton Transactions, 2009, 7390-7395
7002170 CIFC52 H52 Cl3 Mn3 N8 O18I 1 2/m 111.331; 21.547; 12.817
90; 93.67; 90		3122.8Prescimone, Alessandro; Sanchez-Benitez, Javier; Kamenev, Konstantin V.; Moggach, Stephen A.; Lennie, Alistair R.; Warren, John E.; Murrie, Mark; Parsons, Simon; Brechin, Euan K.
High pressure effects on a trimetallic MnII/III SMM
Dalton Transactions, 2009, 7390-7395
7004311 CIFC7 H6 Br N2 O3 ReI 1 2/m 15.9303; 7.8984; 11.8361
90; 102.334; 90		541.61Kromer, Lukas; Spingler, Bernhard; Alberto, Roger
Substitution reactions with [ReBr2(CO)2(NCCH3)2]−: a convenient route to complexes with the cis-[Re(CO)2]+ core
Dalton Transactions, 2008, 5800-5806
7005956 CIFC44 H80 Mo2 N12I 1 2/m 110.206; 15.864; 15.607
90; 105.716; 90		2432.4Cotton, F. Albert; Murillo, Carlos A.; Wang, Xiaoping; Wilkinson, Chad C.
Increasing the solubility of strong reducing agents containing Mo(2)(4+) units and alkyl-substituted guanidinate ligands.
Dalton transactions (Cambridge, England : 2003), 2007, 3943-3951
7009999 CIFC10 H10 Cl4 N2 PtI 1 2/m 16.6548; 11.695; 8.146
90; 91.32; 90		633.8Gillon, Amy L.; Lewis, Gareth R.; Orpen, A. Guy; Rotter, Sarah; Starbuck, Jonathan; Wang, Xi-Meng; Rodríguez-Martín, Yolanda; Ruiz-Pérez, Catalina
Organic‒inorganic hybrid solids: control of perhalometallate solid state structures †
Journal of the Chemical Society, Dalton Transactions, 2000, 3897
7013013 CIFC72 H114 Cl2 Mg2 N4I 1 2/m 112.2182; 17.9539; 16.4195
90; 97.653; 90		3569.8Dove, Andrew P.; Gibson, Vernon C.; Hormnirun, Pimpa; Marshall, Edward L.; Segal, John A.; White, Andrew J. P.; Williams, David J.
Low coordinate magnesium chemistry supported by a bulky ?-diketiminate ligand
Dalton Transactions, 2003, 3088
7019957 CIFC11 H11 Br N O TeI 1 2/m 111.6722; 6.9965; 15.7268
90; 106.463; 90		1231.67Rakesh, Prakul; Singh, Harkesh B.; Butcher, Ray J.
Isolation and molecular structures of novel organotellurium(iv) halides, oxyhalide and mixed halide.
Dalton transactions (Cambridge, England : 2003), 2012, 41, 10707-10714
7021663 CIFC28 H54 N6 V2I 1 2/m 18.6878; 12.6566; 13.9992
90; 97.749; 90		1525.3Lorber, Christian; Vendier, Laure
Novel aspects of the transamination reaction between Ti(NMe2)4 and primary amines.
Dalton transactions (Cambridge, England : 2003), 2013, 42, 12203-12219

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