Crystallography Open Database

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1000429 CIFBa0.83 Ca2.1 In6 O12P 39.888; 9.888; 3.217
90; 90; 120		272.4Baldinozzi, G; Goutenoire, F; Hervieu, M; Suard, E; Grebille, D
Incommensurate modulated disorder in Ba0.85 Ca2.15 In6 O12
Acta Crystallographica B (39,1983-), 1996, 52, 780-789
1001038 CIFF6 Na2 UP 36.112; 6.112; 7.24
90; 90; 120		234.2Cousson, A; Tabuteau, A; Pages, M; Gasperin, M
Disodium uranium(IV) fluoride
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1198-1200
1001210 CIFCd Cl6 H24 Ni2 O12P 39.9509; 9.9509; 11.2393
90; 90; 120		963.8Leclaire, A; Borel, M M
Structure de l'Hexachlorure de Cadmium et de Dinckel Dodecahydrate
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 234-236
1004127 CIFB H16 Li O10P 36.5534; 6.5534; 6.174
90; 90; 120		229.6Touboul, M; Betourne, E; Nowogrocki, G
Crystal structure and dehydration process of Li (H2 O)4 B (O H)4 . 2(H2 O)
Journal of Solid State Chemistry, 1995, 115, 549-553
1010151 CIFBr3 CrP 36.26; 6.26; 18.2
90; 90; 120		617.7Braekken, H
Die Kristallstruktur von Chromtribromid
Kongelige Norske Videnskapers Selskab, Forhandlinger, 1932, 5, 42-42
1010622 CIFBi I3P 37.498; 7.498; 20.676
90; 90; 120		1006.7Braekken, H
Die Kristallstruktur der Trijodide von Arsen, Antimon und Wismut
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977), 1930, 74, 67-72
1510332 CIFAu1.01 Cd0.99P 38.095; 8.095; 5.794
90; 90; 120		328.808Otsuka, K.; Ohba, T.; Emura, Y.
Crystal structure of gamma-martensite and the mechanism of beta2 - zeta2' transformation in a Au49.5 at.% Cd alloy
Materials Transactions, JIM, 1992, 33, 29-37
1511117 CIFB Eu3 O9 WP 38.58; 8.58; 5.41
90; 90; 120		344.907Efremov, V.A.; Chistova, V.I.; Ilyukhin, A.B.; Dzhurinskii, B.F.; Gokhman, L.Z.
Synthesis and structure of boratotungstates Ln3BWO9 (Ln=La,Pr,Nd,Sm-Ho)
Zhurnal Neorganicheskoi Khimii, 1994, 39, 1075-1079
1514873 CIFC9 H26 N2 O12 TiP 315.304; 15.304; 6.6658
90; 90; 120		1352.1Seisenbaeva, Gulaim A.; Daniel, Geoffrey; Nedelec, Jean-Marie; Kessler, Vadim G.
Solution equilibrium behind the room-temperature synthesis of nanocrystalline titanium dioxide.
Nanoscale, 2013, 5, 3330-3336
1516777 CIFC27 H30 O6P 320.637; 20.637; 4.4453
90; 90; 120		1639.6Wright, Nathan E.; ElSohly, Adel M.; Snyder, Scott A.
Syntheses of Cyclotriveratrylene Analogues and Their Long Elusive Triketone Congeners.
Organic letters, 2014, 16, 3644
1521820 CIFCa3.55 Ce1.3 F1.41 H0.63 La0.6 Na2 Nd0.25 O24.63 P5.8 Si0.2 Sr2.3P 39.51; 9.51; 7.01
90; 90; 120		549.047Rastsvetaeva, R.K.; Khomyakov, A.P.
Crystal structure of deloneite-(Ce), a high-order Ca-analog of belovite
Doklady Akad. Nauk, 1996, 349, 354-357
1522872 CIFAl5 MoP 34.933; 4.933; 43.98
90; 90; 120		926.847Schuster, J.C.; Ipser, H.
The Al - Al8 Mo3 section of the binary system aluminum- molybdenum
Metallurgical Transactions A: Physical Metallurgy and Materials Science, 1991, 22, 1729-1738
1523008 CIFBi I TeP 34.346; 4.346; 6.835
90; 90; 120		111.802Tomokiyo, A.; Kawano, S.; Okada, T.
Phase diagram of system (Bi2 Te3)-(Bi I3) and crystal structure of Bi Te I
Japanese Journal of Applied Physics, 1977, 16, 291-298
1525782 CIFRb Sb0.33 Te6 UP 39.0925; 9.0925; 8.129
90; 90; 120		582.015Choi, K.-S.; Kanatzidis, M.G.
Unique periodic modulations in the infinite (Tex)(n-) chains of Rb U Sb0.33 Te6
Journal of Solid State Chemistry, 2001, 161, 17-22
1526857 CIFBe4 N6 O19P 313.638; 13.638; 6.475
90; 90; 120		1042.97Troyanov, S.I.; Tikhomirov, G.A.; Znamenkov, K.O.; Morozov, I.V.
Crystal structure of beryllium nitrate complexes (N O)2 (Be (N O3)4) and Be O (N O3)6
Zhurnal Neorganicheskoi Khimii, 2000, 45, 1941-1948
1527995 CIFBa Ge4 O9P 311.61; 11.61; 4.74
90; 90; 120		553.316Robbins, C.; Perloff, A.; Block, S.
Crystal structure of Ba Ge Ge3 O9 and its relation to benitoite
Journal of Research of the National Bureau of Standards, Section A. Physics and Chemistry, 1966, 70, 385-391
1528032 CIFGe Li1.08 Zn0.92P 34.277; 4.277; 9.373
90; 90; 120		148.487Schoenemann, H.; Schuster, H.U.
Li1.25 Zn Ge und Li Cu0.93 As - zwei isotype Phasen
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1977, 432, 87-94
1528033 CIFAs Cu0.93 LiP 34.125; 4.125; 9.025
90; 90; 120		132.992Schoenemann, H.; Schuster, H.U.
Li1.25 Zn Ge und Li Cu0.93 As - zwei isotype Phasen
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1977, 432, 87-94
1528813 CIFC0.36 Al30 Ca11.415 Cl1.56 K9.789 Na18.423 O154.74 S5.45 Si30P 312.847; 12.847; 26.461
90; 90; 120		3782.16Rastsvetaeva, R.K.; Chukanov, N.V.; Ivanova, A.G.
Crystal structure of a new ten-layer feldspathoid of the cancrinite group
Kristallografiya, 2009, 54, 223-230
1529638 CIFFe1.17 Li1.8 S2P 33.908; 3.908; 6.279
90; 90; 120		83.048Blandeau, L.; Ouvrard, G.; Rouxel, J.; Brec, R.; Calage, Y.
Transition-metal dichalcogenides from disintercalation processes. Crystal structure determination and Moessbauer study of Li2 Fe S2 and its disintercalates Lix Fe S2 (0.2< x< 2)
Journal of Physics C, 1987, 20, 4271-4281
1529641 CIFK2 O9 Si3 ZrP 36.926; 6.926; 10.177
90; 90; 120		422.781Blinov, V.A.; Shumyatskaya, N.G.; Ilyukhin, V.V.; Belov, N.V.; Voronkov, A.A.
Refinement of the crystal structure of wadeite K2 Zr (Si3 O9) and its relation to kindred structural types
Kristallografiya, 1977, 22, 59-65
1530161 CIFH Ni2P 32.643; 2.643; 4.308
90; 90; 120		26.062Khodyrev, Yu.P.; Baranova, R.V.; Imamov, R.M.; Semiletov, S.A.
Electron diffraction investigation of hexagonal nickel hydride
Kristallografiya, 1978, 23, 724-728
1530482 CIFAl12 O25 Sr7P 317.91; 17.91; 7.16
90; 90; 120		1989Nevskii, N.N.; Ilyukhin, V.V.; Glasser, L.D.; Belov, N.V.
The crystal structure of the simplest strontium aluminate with three-dimensional framework
Doklady Akademii Nauk SSSR, 1978, 241, 821-824
1530956 CIFMn O6 Sb2P 38.8056; 8.8056; 4.7232
90; 90; 120		317.165Vincent, H.; Turrillas, X.M.; Rasines, I.
A novel structure type of hexagonal closest packing: The ternary oxide, beta Mn Sb2 O6
Materials Research Bulletin, 1987, 22, 1369-1379
1531202 CIFO2 Si1.016P 38.31; 8.31; 5.205
90; 90; 120		311.282Bolotina, N.B.; Bendeliani, N.A.; Lityagina, L.M.; Dyuzheva, T.I.
Structure investigations of single crystals of stishovite
Poverkhnostnye Fizika, Khimiya, Mekhanika, 2002, 2002, 20-24
1535552 CIFLa Nb7 O19P 36.2531; 6.2531; 20.0685
90; 90; 120		679.573Hofmann, R.; Gruehn, R.
Zur Darstellung und Struktur neuer Niobate: LnNb7O19 (Ln = La, Ce)
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1991, 602, 105-117
1535859 CIFCr F2 Na5 O8 P2P 310.576; 10.576; 6.669
90; 90; 120		646.003Nagornyi, P.G.; Tret'yak, S.M.; Kornienko, Z.I.; Kapshuk, A.A.; Mitkevich, V.V.
Synthesis and structure of new fluorophosphate Na5Cr(PO4)2F2
Zhurnal Neorganicheskoi Khimii, 1990, 35, 839-842
1536253 CIFH2 O Si2P 33.83; 3.83; 5.9
90; 90; 120		74.951Dahn, J.R.; Way, B.M.; Tse, J.S.; Fuller, E.
Structures of siloxene and layered polysilane (Si6 H6)
Physical Review, Serie 3. B - Condensed Matter (18,1978-), 1993, 48, 17872-17877
1536434 CIFGe3 O11 Pb5P 310.19; 10.19; 10.624
90; 90; 120		955.36Kay, M.I.; Newnham, R.E.; Wolfe, R.W.
The crystal structure of the ferroelectric phase of Pb5 Ge3 O11
Ferroelectrics, 1975, 9, 1-6
1538533 CIFAl36 Ca15.94 Cl8 K0.96 Na31.1 O183.3 S10 Si36P 312.757; 12.757; 32.211
90; 90; 120		4539.75Rozenberg, K.A.; Sapozhnikov, A.N.; Kashaev, A.A.; Rastsvetaeva, R.K.; Bolotina, N.B.
Crystal structure and of a new representative of the cancrinite group with a 12-layer staking sequence of tetrahedral rings
Kristallografiya, 2004, 49, 714-721
1539132 CIFCo I2 O6P 310.9597; 10.9597; 5.0774
90; 90; 120		528.165Svensson, C.; Abrahams, S.C.; Bernstein, J.L.
Crystal Structure and Pyroelectric Coefficient of Co (I O3)2 and Structural Relationships among the Anhydrous Noncentrosymmetric 3d-Transition Metal Iodates
Journal of Solid State Chemistry, 1981, 36, 195-204
1540884 CIFIn Si Te3P 37.0411; 7.0411; 7.1001
90; 90; 120		304.843Sandre, E.; Carteaux, V.; Ouvrard, G.
A new lamellar tellurosilicate In Si Te3
Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie 2 (1984-1993), 1992, 314, 1151-1156
1547730 CIFC27 H24 S6P 339.0759; 39.0759; 7.99482
90; 90; 120		10572Shoji, Yoshiaki; Kajitani, Takashi; Ishiwari, Fumitaka; Ding, Qiang; Sato, Hiroyasu; Anetai, Hayato; Akutagawa, Tomoyuki; Sakurai, Hidehiro; Fukushima, Takanori
Hexathioalkyl sumanenes: An electron-donating buckybowl as a building block for supramolecular materials
Chem. Sci., 2017
1548235 CIFH14 Mo6 N2 O24 TeP 312.56; 12.56; 3.944
90; 90; 120		539Zhenxin Zhang; Toru Murayama; Masahiro Sadakane; Hiroko Ariga; Nobuhiro Yasuda; Norihito Sakaguchi; Kiyotaka Asakura; Wataru Ueda
Ultrathin inorganic molecular nanowire based on polyoxometalates
Nature Communications, 2015, 6, 7731
1550831 CIFC6 H12 Fe Mg Na O18P 39.756; 9.756; 10.117
90; 90; 120		833.9Huskic, Igor; Novendra, Novendra; Lim, Dae-Woon; Topić, Filip; Titi, Hatem M.; Pekov, I. V.; Krivovichev, S.; Navrotsky, Alexandra; Kitagawa, Hiroshi; Friščić, Tomislav
Functionality in Metal-Organic Framework Minerals: Proton Conductivity, Stability and Potential for Polymorphism
Chemical Science, 2019
1551343 CIFC488 H460 Cl12 N80 O88P 329.331; 29.331; 59.183
90; 90; 120		44094Soumen De; Bo Chi; Thierry Granier; Ting Qi; Victor Maurizot; Ivan Huc
Designing cooperatively folded abiotic uni- and multimolecular helix bundles
Nature Chemistry, 2018, 10, 51-57
1552001 CIFC2 H0 Na O4 SP 39.512; 9.512; 3.987
90; 90; 120		312.41Jeff A. Hurd; Ramanathan Vaidhyanathan; Venkataraman Thangadurai; Christopher I. Ratcliffe; Igor L. Moudrakovski; George K. H. Shimizu
Anhydrous proton conduction at 150 C in a crystalline metal-organic framework
Nature Chemistry, 2009, 1, 705-710
1553646 CIFC24 H27 B2 F11 Fe N6P 316.8376; 16.8376; 7.8829
90; 90; 120		1935.43Thorarinsdottir, Agnes E.; Gaudette, Alexandra I.; Harris, T. David
Spin-crossover and high-spin iron(ii) complexes as chemical shift <sup>19</sup>F magnetic resonance thermometers.
Chemical science, 2017, 8, 2448-2456
1558013 CIFBe4 H51 I2 N19P 39.7756; 9.7756; 8.7186
90; 90; 120		721.55Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558015 CIFBe4 Br2 H36 N14P 314.2177; 14.2177; 8.56
90; 90; 120		1498.5Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558016 CIFBe4 Cl2 H36 N14P 313.9342; 13.9342; 8.3727
90; 90; 120		1407.86Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1558020 CIFC2 H36 Be4 N16P 314.1334; 14.1334; 8.5563
90; 90; 120		1480.16Müller, Matthias; Karttunen, Antti J.; Buchner, Magnus R.
Speciation of Be2+ in acidic liquid ammonia and formation of tetra- and octanuclear beryllium amido clusters
Chemical Science, 2020, 11, 5415-5422
1559218 CIFAl27 K24.67 Na2.33 O108 Si27P 327.0597; 27.0597; 8.5587
90; 90; 120		5427.3Mugnaioli, Enrico; Bonaccorsi, Elena; Lanza, Arianna E.; Elkaim, Erik; Diez-Gómez, Virginia; Sobrados, Isabel; Gemmi, Mauro; Gregorkiewitz, Miguel
The structure of kaliophilite KAlSiO~4~, a long-lasting crystallographic problem
IUCrJ, 2020, 7
1559870 CIFC60 H94.33 O2.33 S10P 320.793; 20.793; 16.882
90; 90; 120		6321Solel, Ephrath; Pappo, Doron; Reany, Ofer; Mejuch, Tom; Gershoni-Poranne, Renana; Botoshansky, Mark; Stanger, Amnon; Keinan, Ehud
Flat corannulene: when a transition state becomes a stable molecule
Chemical Science, 2020, 11, 13015-13025
1562155 CIFMn3 O14 P2 Pb3 TeP 322.43472; 22.43472; 5.33154
90; 90; 120		2323.94Silverstein, Harlyn J.; Huq, Ashfia; Lee, Minseong; Choi, Eun Sang; Zhou, Haidong; Wiebe, Christopher R.
Nuclear and magnetic supercells in the multiferroic candidate: Pb3TeMn3P2O14
Journal of Solid State Chemistry, 2015, 221, 216-223
1562286 CIFC102 H96 N12 O36 Pr2P 319.06; 19.06; 11.965
90; 90; 120		3764.3Song, Xue-Qin; Lei, Yao-Kun; Wang, Xiao-Run; Zhao, Meng-Meng; Peng, Yun-Qiao; Cheng, Guo-Quan
Lanthanide coordination polymers: Synthesis, diverse structure and luminescence properties
Journal of Solid State Chemistry, 2014, 218, 202-212
2000125 CIFC22 H52 F4 Ga4 N4 O16 P4P 320.0746; 20.0746; 8.5839
90; 90; 120		2995.77Reinert, P.; Patarin, J.; Loiseau, T.; Férey, G.; Kessler, H.
Synthesis, characterization and structure determination of a new fluorogallophosphate (Mu-3) prepared in the presence of ethylene glycol as main solvent
Microporous and Mesoporous Materials, 1998, 22, 43-55
2002126 CIFCr3 O9 Sr4P 39.6182; 9.6182; 7.8736
90; 90; 120		630.8Cuno, E; Mueller-Buschbaum, Hk
ZUr Kenntnis eines gemischtvalenten Oxochromats(III,IV): Sr4 Cr3 O9
Zeitschrift fuer Anorganische und Allgemeine Chemie, 1989, 572, 175-180
2002161 CIFLa O6 Te0.75 Ti1.25P 35.141; 5.141; 5.218
90; 90; 120		119.4Wulff, L; Mueller-Buschbaum, H
Synthese und Kristallstruktur des Lanthan-Titanat-Tellurats La Ti (Ti0.25 Te0.75) O6 und seine Verwandtschaft mit Pb Sb2 O6 und Sr (Mn Te) O6
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-), 1998, 53, 149-152
2010630 CIF
HKL
Paper		C12 H60 Cl7 Co2 N12 Na O6P 311.415; 11.415; 8.0552
90; 90; 120		909Farrugia, Louis J.; Peacock, Robert D.; Stewart, Brian
Redetermination of the double salt Λ-[tris(ethylenediamine)cobalt(III) trichloride]‒sodium chloride‒water (2/1/6)
Acta Crystallographica Section C, 2000, 56, 149-151
2011309 CIF
HKL
Paper		C54 H45 Cl Ni P3P 319.0125; 19.0125; 10.4507
90; 90; 120		3271.6Ellis, Dianne D.; Spek, Anthony L.
Chlorobis(triphenylphosphine)nickel(I) tetrahydrofuran solvate and an unsolvated trigonal phase of chlorotris(triphenylphosphine)nickel(I)
Acta Crystallographica Section C, 2000, 56, 1067-1070
2011660 CIF
Paper		Na4 O12 Ti5P 35.31997; 5.31997; 9.5567
90; 90; 120		234.238Avdeev, Maxim; Kholkin, Andrei
Low-temperature Na~4~Ti~5~O~12~ from X-ray and neutron powder diffraction data
Acta Crystallographica Section C, 2000, 56, e539-e540
2016713 CIF
HKL
Paper		C16 H28 O3P 315.5892; 15.5892; 5.6424
90; 90; 120		1187.52Stilinović, Vladimir; Kaitner, Branko
Partial ordering of tripivaloylmethane at 110K
Acta Crystallographica Section C, 2008, 64, o450-o452
2019308 CIF
Paper		H9 N6 O9 RhP 37.496; 7.496; 5.256
90; 90; 120		255.77Vasiliev, Alexander D.; Molokeev, Maxim S.; Baidina, Iraida A.; Belyaev, Anatoly V.; Vorob'eva, Sofiya N.
Arrangement of Rh^3+^ ions in <i>fac</i>-triamminetrichloridorhodium from powder data and in <i>fac</i>-triamminetrinitratorhodium crystals twinned by merohedry
Acta Crystallographica Section C, 2013, 69, 1462-1466
2020218 CIFF12 H24 N6 O12 S3 Sb4P 317.07; 17.07; 7.515
90; 90; 120		1896.39Waskowska, A.; Lis, T.
Structure of hexaammonium dodecafluorotrisulfato tetraantimonate(III) at 300K
Acta Crystallographica C (39,1983-), 1988, 44, 1342-1345
2022130 CIF
HKL
Paper		C9 H12 N4 O6P 312.7917; 12.7917; 5.8996
90; 90; 120		836.01Domasevitch, Kostiantyn V.; Senchyk, Ganna A.; Krautscheid, Harald
Bulk polarity of 3,5,7-trinitro-1-azaadamantane mediated by asymmetric NO~2~(lone pair)···NO~2~(π-hole) supramolecular bonding
Acta Crystallographica Section C, 2020, 76
2100674 CIF
Paper		As Ga O4P 38.2033195; 8.2033195; 4.3941092
90; 90; 120		256.083Santamaría-Pérez, David; Haines, Julien; Amador, Ulises; Morán, Emilio; Vegas, Angel
Structural characterization of a new high-pressure phase of GaAsO~4~
Acta Crystallographica Section B, 2006, 62, 1019-1024
2101950 CIF
Paper		C16 H22 N6P 316.152; 16.152; 5.353
90; 90; 120		1209.4Ochando, L. E.; Rius, J.; Louër, D.; Claramunt, R. M.; Lopez, C.; Elguero, J.; Amigó, J. M.
Phase Transitions in Tris(3,5-dimethylpyrazol-1-yl)methane. The Structure of the High-Temperature Phase from X-ray Powder Diffraction
Acta Crystallographica Section B, 1997, 53, 939-944
2103731 CIF
Paper		C6 H11 N OP 320.983; 20.983; 7.621
90; 90; 120		2905.88Olivato, Paulo R.; Ribeiro, Douglas S.; Zukerman-Schpector, J.; Bombieri, Gabriella
Self-association and stereochemistry study of 2-methylthio-, 2-dimethylaminocyclohexanone oximes and the parent cyclohexanone oxime
Acta Crystallographica Section B, 2001, 57, 705-713
2104666 CIF
Paper		Ge9 O33 Pb15P 310.22887; 10.22887; 10.66337
90; 90; 120		966.23Baikie, Tom; Pramana, Stevin S.; Ferraris, Cristiano; Huang, Yizhong; Kendrick, Emma; Knight, Kevin S.; Ahmad, Zahara; White, T. J.
Polysomatic apatites
Acta Crystallographica Section B, 2010, 66, 1-16
2104667 CIF
Paper		Bi1.5 Ge9 Na1.5 O33 Pb12P 310.13385; 10.13385; 10.52045
90; 90; 120		935.651Baikie, Tom; Pramana, Stevin S.; Ferraris, Cristiano; Huang, Yizhong; Kendrick, Emma; Knight, Kevin S.; Ahmad, Zahara; White, T. J.
Polysomatic apatites
Acta Crystallographica Section B, 2010, 66, 1-16
2104668 CIF
Paper		Bi3 Ge9 Na3 O33 Pb9P 310.08745; 10.08745; 10.40506
90; 90; 120		916.934Baikie, Tom; Pramana, Stevin S.; Ferraris, Cristiano; Huang, Yizhong; Kendrick, Emma; Knight, Kevin S.; Ahmad, Zahara; White, T. J.
Polysomatic apatites
Acta Crystallographica Section B, 2010, 66, 1-16
2108521 CIF
HKL		Cu6 H16 O21 S2 ZnP 38.1905; 8.1905; 7.099
90; 90; 120		412.43Elliott, Peter
Hodgesmithite, (Cu,Zn)~6~Zn(SO~4~)~2~(OH)~10~·3H~2~O, a new copper zinc sulfate mineral with a unique, decorated, interrupted-sheet structure
Acta Crystallographica Section B, 2019, 75
2200391 CIF
HKL
Paper		C10 H24 N2 O8 S3P 310.281; 10.281; 14.788
90; 90; 120		1353.7N. Srinivasan; B. Sridhar; R. K. Rajaram
Bis(<small>DL</small>-methioninium) sulfate
Acta Crystallographica Section E, 2001, 57, o746-o748
2226327 CIF
HKL
Paper		B4 O7 SrP 317.145; 17.145; 4.2527
90; 90; 120		1082.61Vasiliev, Alexander D.; Cherepakhin, Alexander V.; Zaitsev, Alexander I.
The trigonal polymorph of strontium tetraborate, β-SrB~4~O~7~
Acta Crystallographica Section E, 2010, 66, i48
2311858 CIF
Paper		C56 H108 F6 Mg N6 O33 S2P 316.4188; 16.4188; 8.8395
90; 90; 120		2063.67Fujita, Megumi; Kazerouni, Amaan M.; Bacsa, John
The structure of a valinomycin-hexaaquamagnesium trifluoromethanesulfonate compound.
Acta crystallographica. Section C, Structural chemistry, 2016, 72, 627-633
2312129 CIF
HKL
Paper		C12 H60 Cl7 Co2 N12 Na O6P 311.32; 11.32; 8.049
90; 90; 120		893.2Kollitz, Megan R.; Lappin, A. Graham; Oliver, Allen G.
Double-salt formation in crystal structures containing [Co(en)<sub>3</sub>]Cl<sub>3</sub>.
Acta crystallographica. Section C, Structural chemistry, 2023, 79, 164-169
3000455 CIFC8 H6 Mg3 O6P 35.05475; 5.05475; 38.8242
90; 90; 120		859.078Gianfranco Ulian; Giovanni Valdrè
Facile band gap tuning in graphene brucite heterojunctions
Scientific Reports, 2023, 13, 23090
3000457 CIFC8 H6 Mg3 O6P 35.05489; 5.05489; 38.844898
90; 90; 120		859.583Gianfranco Ulian; Giovanni Valdrè
Facile band gap tuning in graphene brucite heterojunctions
Scientific Reports, 2023, 13, 23090
4001757 CIFC31.67 H31.67 N4 Ni2 O12.67P 316.586; 16.586; 18.124
90; 90; 120		4318Jeong, Seok; Kim, Dongwook; Song, Xiaokai; Choi, Min; Park, Noejung; Lah, Myoung Soo
Postsynthetic Exchanges of the Pillaring Ligand in Three-Dimensional Metal‒Organic Frameworks
Chemistry of Materials, 2013, 25, 1047
4001758 CIFC34 H28 N4 Ni2 O12P 316.634; 16.634; 18.194
90; 90; 120		4359.7Jeong, Seok; Kim, Dongwook; Song, Xiaokai; Choi, Min; Park, Noejung; Lah, Myoung Soo
Postsynthetic Exchanges of the Pillaring Ligand in Three-Dimensional Metal‒Organic Frameworks
Chemistry of Materials, 2013, 25, 1047
4002831 CIFBi13 I2 S18P 315.612; 15.612; 4.0168
90; 90; 120		847.9Groom, Ryan; Jacobs, Allison; Cepeda, Marisa; Drummey, Rachel; Latturner, Susan E.
Bi13S18I2: (Re)discovery of a Subvalent Bismuth Compound Featuring [Bi2]4+ Dimers Grown in Sulfur/Iodine Flux Mixtures
Chemistry of Materials, 2017
4036766 CIFC21.67 H36 Ho0 O17.67P 311.0527; 11.0527; 18.729
90; 90; 120		1981.4Maiti, Krishnagopal; Jayaraman, Narayanaswamy
Synthesis and Structure of Cyclic Trisaccharide with Expanded Glycosidic Linkages.
The Journal of organic chemistry, 2016, 81, 4616-4622
4108180 CIFC33 H66 Br8 Cu8 N6 O3P 315.2582; 15.2582; 6.6579
90; 90; 120		1342.4Wen Zhang; Ren-Gen Xiong; Songping D. Huang
3D Framework Containing Cu4Br4 Cubane as Connecting Node with Strong Ferroelectricity
Journal of the American Chemical Society, 2008, 130, 10468-10469
4110994 CIFC12 H24 Ag Cl2 O8 S6P 310.973; 10.973; 5.23
90; 90; 120		545.4Jennifer L. Shaw; Joanna Wolowska; David Collison; Judith A. K. Howard; Eric J. L. McInnes; Jonathan McMaster; Alexander J. Blake; Claire Wilson; Martin Schröder
Redox Non-innocence of Thioether Macrocycles: Elucidation of the Electronic Structures of Mononuclear Complexes of Gold(II) and Silver(II)
Journal of the American Chemical Society, 2006, 128, 13827-13839
4110995 CIFC12 H24 Ag Cl2 O8 S6P 310.851; 10.851; 5.186
90; 90; 120		528.8Jennifer L. Shaw; Joanna Wolowska; David Collison; Judith A. K. Howard; Eric J. L. McInnes; Jonathan McMaster; Alexander J. Blake; Claire Wilson; Martin Schröder
Redox Non-innocence of Thioether Macrocycles: Elucidation of the Electronic Structures of Mononuclear Complexes of Gold(II) and Silver(II)
Journal of the American Chemical Society, 2006, 128, 13827-13839
4114583 CIFC18 H30.5 Cl1.5 Co N10 O4P 312.277; 12.2772; 9.321
90; 90; 120		1216.7Ikuko Katsuki; Yuri Motoda; Yukinari Sunatsuki; Naohide Matsumoto; Toshio Nakashima; Masaaki Kojima
Spontaneous Resolution Induced by Self-Organization of Chiral Self-Complementary Cobalt(III) Complexes with Achiral Tripod-Type Ligands Containing Three Imidazole Groups
Journal of the American Chemical Society, 2002, 124, 629-640
4115954 CIFC180 H144 F72 N36 Os3 P12 Ru3P 318.4189; 18.4189; 16.2309
90; 90; 120		4768.7Josef Breu; Cornelius Kratzer; Hartmut Yersin
Crystal Engineering as a Tool for Directed Radiationless Energy Transfer in Layered {Λ-[Ru(bpy)3]Δ-[Os(bpy)3]}(PF6)4
Journal of the American Chemical Society, 2000, 122, 2548-2555
4120480 CIFC63.67 H79.33 Cl7.33 N12P 324.075; 24.075; 10.7146
90; 90; 120		5378.2Hasell, Tom; Culshaw, Jamie L.; Chong, Samantha Y.; Schmidtmann, Marc; Little, Marc A.; Jelfs, Kim E.; Pyzer-Knapp, Edward O; Shepherd, Hilary; Adams, Dave J.; Day, Graeme M.; Cooper, Andrew I.
Controlling the crystallization of porous organic cages: molecular analogs of isoreticular frameworks using shape-specific directing solvents.
Journal of the American Chemical Society, 2014, 136, 1438-1448
4130594 CIFC6 Br4 Cl2 Ga N2 S4P 313.6489; 13.6489; 7.9023
90; 90; 120		1274.91Postulka, Lars; Winter, Stephen M.; Mihailov, Adam G.; Mailman, Aaron; Assoud, Abdeljalil; Robertson, Craig M.; Wolf, Bernd; Lang, Michael; Oakley, Richard T.
Spin Frustration in an Organic Radical Ion Salt Based on a Kagome-Coupled Chain Structure.
Journal of the American Chemical Society, 2016, 138, 10738-10741
4133032 CIFC22 H9 Cl3 Fe2 N9 O12P 313.5493; 13.5493; 9.484
90; 90; 120		1507.8Sahadevan, Suchithra Ashoka; Abhervé, Alexandre; Monni, Noemi; Sáenz de Pipaón, Cristina; Galán-Mascarós, José Ramón; Waerenborgh, João C; Vieira, Bruno J. C.; Auban-Senzier, Pascale; Pillet, Sébastien; Bendeif, El-Eulmi; Alemany, Pere; Canadell, Enric; Mercuri, Maria Laura; Avarvari, Narcis
Conducting Anilate-Based Mixed-Valence Fe(II)Fe(III) Coordination Polymer: Small-Polaron Hopping Model for Oxalate-Type Fe(II)Fe(III) 2D Networks.
Journal of the American Chemical Society, 2018, 140, 12611-12621
4133033 CIFC22 H67 Cl3 Fe2 N9 O41P 313.616; 13.616; 9.43
90; 90; 120		1514.1Sahadevan, Suchithra Ashoka; Abhervé, Alexandre; Monni, Noemi; Sáenz de Pipaón, Cristina; Galán-Mascarós, José Ramón; Waerenborgh, João C; Vieira, Bruno J. C.; Auban-Senzier, Pascale; Pillet, Sébastien; Bendeif, El-Eulmi; Alemany, Pere; Canadell, Enric; Mercuri, Maria Laura; Avarvari, Narcis
Conducting Anilate-Based Mixed-Valence Fe(II)Fe(III) Coordination Polymer: Small-Polaron Hopping Model for Oxalate-Type Fe(II)Fe(III) 2D Networks.
Journal of the American Chemical Society, 2018, 140, 12611-12621
4133181 CIFC42 H66 Cl6 I0.84 N6P 343.918; 43.918; 13.7792
90; 90; 120		23017Chaix, Arnaud; Mouchaham, Georges; Shkurenko, Aleksander; Hoang, Phuong; Moosa, Basem; Bhatt, Prashant M.; Adil, Karim; Salama, Khaled N.; Eddaoudi, Mohamed; Khashab, Niveen M.
Trianglamine-Based Supramolecular Organic Framework with Permanent Intrinsic Porosity and Tunable Selectivity.
Journal of the American Chemical Society, 2018, 140, 14571-14575
4133249 CIFC37 H52P 323.2294; 23.2294; 10.0567
90; 90; 120		4699.6Rösel, Sören; Becker, Jonathan; Allen, Wesley D.; Schreiner, Peter R.
Probing the Delicate Balance between Pauli Repulsion and London Dispersion with Triphenylmethyl Derivatives.
Journal of the American Chemical Society, 2018, 140, 14421-14432
4133704 CIFC42 H51 B F4 Fe N8 OP 319.1778; 19.1778; 9.8155
90; 90; 120		3126.4Keilwerth, Martin; Hohenberger, Johannes; Heinemann, Frank W.; Sutter, Jörg; Scheurer, Andreas; Fang, Huayi; Bill, Eckhard; Neese, Frank; Ye, Shengfa; Meyer, Karsten
A Series of Iron Nitrosyl Complexes {Fe-NO}<sup>6-9</sup> and a Fleeting {Fe-NO}<sup>10</sup> Intermediate en Route to a Metalacyclic Iron Nitrosoalkane.
Journal of the American Chemical Society, 2019, 141, 17217-17235
4305618 CIFC61 H69 Cr3 Mn3 N8 O36P 315.966; 15.966; 9.36
90; 90; 120		2066.3Miguel Clemente-León; Eugenio Coronado; Joao C. Dias; Alejandra Soriano-Portillo; Roger D. Willett
Synthesis, Structure, and Magnetic Properties of [(S)-[PhCH(CH3)N(CH3)3]][Mn(CH3CN)2/3Cr(ox)3].(CH3CN)_(solvate), a 2D Chiral Magnet Containing a Quaternary Ammonium Chiral Cation
Inorganic Chemistry, 2008, 47, 6458-6463
4309213 CIFC42 H79 Br8 In5 N6P 321.359; 21.359; 15.206
90; 90; 120		6007.7Marcus L. Cole; Cameron Jones; Marc Kloth
Controlled Decomposition of an Indium Trihydride Adduct: Synthesis and Characterization of the First Mixed-Oxidation-State Indium Sub-halide Complex Anion, [In5Br8(quinuclidine)4]-
Inorganic Chemistry, 2005, 44, 4909-4911
4311301 CIFC36 H45 B2 F8 Fe2 N20P 311.8047; 11.8047; 9.3705
90; 90; 120		1130.85Yukinari Sunatsuki; Hiromi Ohta; Masaaki Kojima; Yuichi Ikuta; Yoshiyuki Goto; Naohide Matsumoto; Seiichiro Iijima; Haruo Akashi; Sumio Kaizaki; Françoise Dahan; Jean-Pierre Tuchagues
Supramolecular Spin-Crossover Iron Complexes Based on Imidazole-Imidazolate Hydrogen Bonds
Inorganic Chemistry, 2004, 43, 4154-4171
4311302 CIFC36 H45 B2 F8 Fe2 N20P 311.9346; 11.9346; 9.4354
90; 90; 120		1163.88Yukinari Sunatsuki; Hiromi Ohta; Masaaki Kojima; Yuichi Ikuta; Yoshiyuki Goto; Naohide Matsumoto; Seiichiro Iijima; Haruo Akashi; Sumio Kaizaki; Françoise Dahan; Jean-Pierre Tuchagues
Supramolecular Spin-Crossover Iron Complexes Based on Imidazole-Imidazolate Hydrogen Bonds
Inorganic Chemistry, 2004, 43, 4154-4171
4311303 CIFC36 H45 B2 F8 Fe2 N20P 311.9678; 11.9678; 28.5739
90; 90; 120		3544.3Yukinari Sunatsuki; Hiromi Ohta; Masaaki Kojima; Yuichi Ikuta; Yoshiyuki Goto; Naohide Matsumoto; Seiichiro Iijima; Haruo Akashi; Sumio Kaizaki; Françoise Dahan; Jean-Pierre Tuchagues
Supramolecular Spin-Crossover Iron Complexes Based on Imidazole-Imidazolate Hydrogen Bonds
Inorganic Chemistry, 2004, 43, 4154-4171
4311692 CIFC36 H71 Fe N5 O51 Ti2P 315.4413; 15.441; 7.6252
90; 90; 120		1574.49Yuan-Fu Deng; Zhao-Hui Zhou; Hui-Lin Wan
pH-Dependent Isolations and Spectroscopic, Structural, and Thermal Studies of Titanium Citrate Complexes
Inorganic Chemistry, 2004, 43, 6266-6273
4327202 CIFC48 Al6 N3 O117 Si3 W30P 322.3183; 22.3183; 13.2925
90; 90; 120		5734.02Yuji Kikukawa; Kazuya Yamaguchi; Mitsuhiro Hibino; Noritaka Mizuno
Layered Assemblies of a Dialuminum-Substituted Silicotungstate Trimer and the Reversible Interlayer Cation-Exchange Properties
Inorganic Chemistry, 2011, 50, 12411-12413
4327258 CIFC18 H30.5 Br1.5 Co N10 O4P 312.339; 12.339; 9.339
90; 90; 120		1231.4Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto
Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups
Inorganic Chemistry, 2007, 46, 8170-8181
4327259 CIFC18 H26.5 Co I1.5 N10 O2P 312.388; 12.388; 9.389
90; 90; 120		1247.8Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto
Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups
Inorganic Chemistry, 2007, 46, 8170-8181
4327260 CIFC18 H27.5 B1.5 Co F6 N10 O2.5P 312.254; 12.254; 9.299
90; 90; 120		1209.3Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto
Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups
Inorganic Chemistry, 2007, 46, 8170-8181
4327261 CIFC18 H24.5 Cl1.5 Co N10 O7P 312.304; 12.304; 9.315
90; 90; 120		1221.3Hirofumi Nakamura; Yukinari Sunatsuki; Masaaki Kojima; Naohide Matsumoto
Chiral Recognition and Conglomerate Crystallization Induced by Self-Organization of Cobalt(III) Complexes of a Tripodal Ligand Containing Three Imidazole Groups
Inorganic Chemistry, 2007, 46, 8170-8181
4330509 CIFC67 H73 Co3 F6 N6 O0.5 P4P 312.6987; 12.6987; 11.4114
90; 90; 120		1593.6Alison R. Fout; Dianne J. Xiao; Qinliang Zhao; T. David Harris; Evan R. King; Emily V. Eames; Shao-Liang Zheng; Theodore A. Betley
Trigonal Mn3 and Co3 Clusters Supported by Weak-Field Ligands: A Structural, Spectroscopic, Magnetic, and Computational Investigation into the Correlation of Molecular and Electronic Structure
Inorganic Chemistry, 2012, 51, 10290-10299
4334696 CIFC30 H43 Co N17 O17 S3P 323.97; 23.97; 6.6297
90; 90; 120		3298.8Pilar Amo-Ochoa; Simone S. Alexandre; Samira Hribesh; Miguel A. Galindo; Oscar Castillo; Carlos J. Gómez-García; Andrew R. Pike; José M. Soler; Andrew Houlton; Félix Zamora
Coordination Chemistry of 6-Thioguanine Derivatives with Cobalt: Toward Formation of Electrical Conductive One-Dimensional Coordination Polymers
Inorganic Chemistry, 2013, 52, 5290-5299
4334697 CIFC30 H39 Co N15 O13.5 S3P 318.815; 18.815; 6.5787
90; 90; 120		2016.9Pilar Amo-Ochoa; Simone S. Alexandre; Samira Hribesh; Miguel A. Galindo; Oscar Castillo; Carlos J. Gómez-García; Andrew R. Pike; José M. Soler; Andrew Houlton; Félix Zamora
Coordination Chemistry of 6-Thioguanine Derivatives with Cobalt: Toward Formation of Electrical Conductive One-Dimensional Coordination Polymers
Inorganic Chemistry, 2013, 52, 5290-5299
4334698 CIFC30 H42 Co N15 O19 S4P 319.225; 19.225; 6.618
90; 90; 120		2118.3Pilar Amo-Ochoa; Simone S. Alexandre; Samira Hribesh; Miguel A. Galindo; Oscar Castillo; Carlos J. Gómez-García; Andrew R. Pike; José M. Soler; Andrew Houlton; Félix Zamora
Coordination Chemistry of 6-Thioguanine Derivatives with Cobalt: Toward Formation of Electrical Conductive One-Dimensional Coordination Polymers
Inorganic Chemistry, 2013, 52, 5290-5299

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