Crystallography Open Database

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1528731 CIFBi2 O6 WA 1 2/m 18.37422; 3.854296; 16.44044
90; 102.334; 90		518.396McDowell, N.A.; Knight, K.S.; Lightfoot, P.
Unusual high-temperature structural behaviour in ferroelectric Bi2 W O6
Chemistry - A European Journal, 2006, 12, 1493-1499
1541849 CIFC4 H2 Mn N6 OA m a 27.5743; 17.45329; 5.6353
90; 90; 90		744.967Jensen, P.; Price, D.J.; Batten, S.R.; Murray, K.S.; Moubaraki, B.
Self-penetration - a structural compromise between single networks and interpenetration: magnetic properties and crystal structures of (Mn (dca)2 (H2 O)) and (M (dca) (tcm)), M = Co, Ni, Cu, dca = dicyanamide, tcm = tricyanomethanide
Chemistry - A European Journal, 2000, 6, 3186-3195
1528730 CIFBi2 O6 WB 2 c b5.533997; 5.49983; 16.55071
90; 90; 90		503.738McDowell, N.A.; Knight, K.S.; Lightfoot, P.
Unusual high-temperature structural behaviour in ferroelectric Bi2 W O6
Chemistry - A European Journal, 2006, 12, 1493-1499
1509329 CIFAg F6 S16 SbC 1 2/c 117.535; 7.8465; 15.675
90; 102.652; 90		2104.33Cameron, T.S.; Decken, A.; Passmore, J.; Dionne, I.; Min Fang; Krossing, I.
Approaching the gas phase structures of AgS8+ and AgS16+ in the solid state
Chemistry - A European Journal, 2002, 8, 3386-3401
1511744 CIFB4 Gd2 O9C 1 2/c 125.39; 4.433; 24.908
90; 99.88; 90		2761.91Huppertz, H.; Emme, H.
High-pressure preparation, crystal structure and properties of alpha-(RE)2 B4 O9 (RE = Eu, Gd, Tb, Dy): oxoborates displaying a new type of structure with edge-sharing B O4 tetrahedra
Chemistry - A European Journal, 2003, 9, 3623-3633
1535851 CIFC2 N3 RbC 1 2/c 113.8156; 10.00018; 14.43275
90; 116.896; 90		1778.31Irran, E.; Juergens, B.; Schnick, W.
Trimerization of alkali dicyanamides M (N (C N)2) and formation of tricyanomelaminates M3 (C6 N9) (M= K, Rb) in the melt: Crystal structure determination of three polymorphs of K (N (C N)2), two of Rb (N (C N)2), and one of K3 (C6 N9) and Rb3 (C6 N9) from X-ray powder diffractometry
Chemistry - A European Journal, 2001, 7, 5372-5381
1559897 CIFC18 H31 N11 O3 S3C 1 2/c 110.9174; 18.9758; 13.2699
90; 93.486; 90		2743.99Khadivjam, Tinasadat; Che-Quang, Huy; Maris, Thierry; Ajoyan, Zvart; Howarth, Ashlee J.; Wuest, James D.
Modular Construction of Porous Hydrogen-Bonded Molecular Materials from Melams
Chemistry-A European Journal, 2020, 26, 7026-7040
1559898 CIFC40 H70 N44 O11 S2C 1 2/c 125.072; 13.115; 20.79
90; 112.824; 90		6300.9Khadivjam, Tinasadat; Che-Quang, Huy; Maris, Thierry; Ajoyan, Zvart; Howarth, Ashlee J.; Wuest, James D.
Modular Construction of Porous Hydrogen-Bonded Molecular Materials from Melams
Chemistry-A European Journal, 2020, 26, 7026-7040
1559903 CIFC24 H27 N33C 1 2/c 129.648; 34.503; 17.411
90; 107.839; 90		16954Khadivjam, Tinasadat; Che-Quang, Huy; Maris, Thierry; Ajoyan, Zvart; Howarth, Ashlee J.; Wuest, James D.
Modular Construction of Porous Hydrogen-Bonded Molecular Materials from Melams
Chemistry-A European Journal, 2020, 26, 7026-7040
6000243 CIFN7 Na P4C 1 2/c 112.3345; 8.523; 5.1397
90; 102.572; 90		527.37Landskron, K.; Irran, E.; Schnick, W.
High-temperature high-pressure synthesis of the highly condensed nitridophosphates NaP4N7, KP4N7, RbP4N7, and CsP4N7 and their crystal-structure determinations by X-ray powder diffraction
Chemistry - a European Journal, 1999, 5, 2548-2553
1535570 CIFBi11.2 Cs0.65 Pb3.8 Se21C 1 2/m 132.3219; 4.1715; 17.57039
90; 112.69; 90		2185.68Mrotzek, A.; Chung, D.-Y.; Ghelani, N.; Kanatzidis, M.G.; Hogan, T.
Structure and thermoelectric properties of the new quaternary bismuth selenides A1-x M4-x Bi11+x Se21 (A= K, Rb, Cs; M= Sn, Pb) - members of the grand homologous series Km (M6 Se8)m (M5+n Se9+n)
Chemistry - A European Journal, 2001, 7, 1915-1926
1535573 CIFBi12.71 K1.46 Pb1.57 Se21C 1 2/m 131.883; 4.1863; 17.387
90; 112.098; 90		2150.2Mrotzek, A.; Chung, D.-Y.; Hogan, T.; Kanatzidis, M.G.; Ghelani, N.
Structure and thermoelectric properties of the new quaternary bismuth selenides A1-x M4-x Bi11+x Se21 (A = K, Rb, Cs; M = Sn, Pb) - members of the grand homologous series Km (M6 Se8)m (M5+n Se9+n)
Chemistry - A European Journal, 2001, 7, 1915-1926
1535576 CIFBi11.46 K0.54 Se21 Sn3.54C 1 2/m 131.91; 4.1462; 17.311
90; 112.064; 90		2122.6Mrotzek, A.; Chung, D.-Y.; Kanatzidis, M.G.; Hogan, T.; Ghelani, N.
Structure and thermoelectric properties of the new quaternary bismuth selenides A1-x M4-x Bi11+x Se21 (A = K, Rb, Cs; M = Sn, Pb) - members of the grand homologous Series Km (M6 Se8)m (M5+n Se9+n)
Chemistry - A European Journal, 2001, 7, 1915-1926
1535580 CIFBi12.52 Pb2.48 Rb0.69 Se21C 1 2/m 131.991; 4.1937; 17.481
90; 112.519; 90		2166.44Mrotzek, A.; Hogan, T.; Ghelani, N.; Chung, D.-Y.; Kanatzidis, M.G.
Structure and thermoelectric properties of the new quaternary bismuth selenides A1-x M4-x Bi11+x Se21 (A = K, Rb, Cs; M = Sn, Pb) - members of the grand homologous series Km (M6 Se8)m (M5+n Se9+n)
Chemistry - A European Journal, 2001, 7, 1915-1926
1536498 CIFH47 Li3 Mo8 O40 S8 WC 1 2/m 120.6754; 11.1509; 14.5769
90; 133.865; 90		2422.98Dolbecq, A.; du Peloux, C.; Auberty, A.L.; Secheresse, F.; Barboux, P.; Mason, S.A.; Cadot, E.; Marrot, J.
Synthesis, X-ray and neutron diffraction characterization and ionic conduction properties of a new oxothiomolybdate Li3 (Mo8 S8 O8 (O H)8 (H W O5 (H2 O))) * 18(H2 O)
Chemistry - A European Journal, 2002, 8, 350-356
1537097 CIFEu3 Ga4 Ge6C 1 2/m 124.136; 4.3118; 11.0169
90; 91.683; 90		1146.03Zhuraleva, M.A.; Salvador, J.; Bilc, D.; Kannewurf, C.R.; Mahanti, S.D.; Ireland, J.; Kanatzidis, M.G.
Intermetallics as zintl phases: Yb2 Ga4 Ge6 and RE3 Ga4 Ge6 (RE= Yb, Eu): Structural response of a [Ga4 Ge6]4- framework to reduction by two electrons
Chemistry - A European Journal, 2004, 10, 3197-3208
1537102 CIFGa4 Ge6 Yb3C 1 2/m 123.941; 4.1928; 10.918
90; 91.426; 90		1095.61Zhuraleva, M.A.; Salvador, J.; Bilc, D.; Mahanti, S.D.; Ireland, J.; Kanatzidis, M.G.; Kannewurf, C.R.
Intermetallics as zintl phases: Yb2Ga4Ge6 and RE3Ga4Ge6 (RE= Yb, Eu): Structural response of a [Ga4Ge6]4- framework to reduction by two electrons
Chemistry - A European Journal, 2004, 10, 3197-3208
1537099 CIFGa4 Ge6 Yb2C m c 214.1698; 23.254; 10.7299
90; 90; 90		1040.42Zhuraleva, M.A.; Kannewurf, C.R.; Salvador, J.; Ireland, J.; Mahanti, S.D.; Bilc, D.; Kanatzidis, M.G.
Intermetallics as zintl phases: Yb2Ga4Ge6 and RE3Ga4Ge6 (RE= Yb, Eu): Structural response of a [Ga4Ge6]4- framework to reduction by two electrons
Chemistry - A European Journal, 2004, 10, 3197-3208
1536387 CIFIn4 La NiC m c m4.482; 16.895; 7.221
90; 90; 90		546.799Kal'ichak, Ya.M.; Zaremba, V.I.; Galadzhun, Ya.V.; Miliyanchuk, Kh.Yu.; Hoffmann, R.D.; Poettgen, R.
New [Ni7] Cluster in LaNi7In6 and Distorted bcc Indium Cubes in LaNiIn4
Chemistry - A European Journal, 2001, 7, 5343-5349
1536486 CIFLa Se Te2C m c m4.309; 25.481; 4.321
90; 90; 90		474.436Doert, T.; Fokwa, B.P.T.; Simon, P.; Lidin, S.; Soehnel, T.
La Se Te2 - Temperature dependent structure investigation and electron holography on a charge-density-wave-hosting compound
Chemistry - A European Journal, 2003, 9, 5865-5872
1510375 CIFAu2 Cd2 Cs2 S4C m m a6.5833; 14.055; 6.0369
90; 90; 90		558.584Axtell, E.A.; Kanatzidis, M.G.
First examples of gold thiocadmates: A2 Au2 Cd2 S4 (A = Rb, Cs) and K2 Au4 Cd S4 : bright photoluminescence from new alkali metal/gold thiocadmates
Chemistry - A European Journal, 1998, 4, 2435-2441
1535602 CIFIr36.22 Zn369.79F -4 3 m18.214; 18.214; 18.214
90; 90; 90		6042.49Hornfeck, W.; Lee, S.; Thimmaiah, S.; Harbrecht, B.
Structure-composition relations for the Hume-Rothery phase Ir(7+7delta) Zn(97-11delta) (0.31 < delta < 0.58)
Chemistry - A European Journal, 2004, 10, 4616-4626
1535605 CIFIr38.35 Zn367.3F -4 3 m18.224; 18.224; 18.224
90; 90; 90		6052.45Hornfeck, W.; Thimmaiah, S.; Harbrecht, B.; Lee, S.
Structure-composition relations for the Hume-Rothery phase Ir(7+7delta) Zn(97-11delta) (0.31 < delta < 0.58)
Chemistry - A European Journal, 2004, 10, 4616-4626
1535607 CIFIr43.96 Zn358.94F -4 3 m18.224; 18.224; 18.224
90; 90; 90		6052.45Hornfeck, W.; Thimmaiah, S.; Lee, S.; Harbrecht, B.
Structure-composition relations for the Hume-Rothery phase Ir(7+7delta) Zn(97-11delta) (0.31 < delta < 0.58)
Chemistry - A European Journal, 2004, 10, 4616-4626
1537087 CIFS8F d d d :210.393; 12.762; 24.436
90; 90; 90		3241.08Krossing, I.; Cameron, T.S.; Min Fang; Dionne, I.; Decken, A.; Passmore, J.
Approaching the gas phase structures of AgS8+ and AgS16+ in the solid state
Chemistry - A European Journal, 2002, 8, 3386-3401
1534573 CIFK11 P13 S52 U7I -4 2 d32.0481; 32.0481; 17.3208
90; 90; 90		17789.9Gieck, C.; Tremel, W.
Interlocking inorganic screw helices: synthesis, structure and magnetism of the novel framework uranium orthothiophosphates A11 U7 (P S4)13 (A = K, Rb)
Chemistry - A European Journal, 2002, 8, 2980-2987
1534576 CIFP13 Rb11 S52 U7I -4 2 d32.1641; 32.1641; 17.7244
90; 90; 90		18336.4Gieck, C.; Tremel, W.
Interlocking inorganic screw helices: synthesis, structure and magnetism of the novel framework uranium orthothiophosphates A11 U7 (P S4)13 (A = K, Rb)
Chemistry - A European Journal, 2002, 8, 2980-2987
1535475 CIFHg K2 Se4 SnI -4 2 m8.0681; 8.0681; 6.9497
90; 90; 90		452.385Brandmayer, M.K.; Clerac, R.; Weigend, F.; Dehnen, S.
Ortho-Chalcogenostannates as Ligands: Syntheses, Crystal Structures, Electronic Properties, and Magnetism of Novel Compounds Containing Ternary Anionic Substructures [M4(4-Se)(SnSe4)4]10- (M=Mn, Zn, Cd, Hg), {[Hg4(4-Se)(SnSe4)3]6-}, or {[HgSnSe4]2-}
Chemistry - A European Journal, 2004, 10, 5147-5157
1510869 CIFB29 Na2I 1 m 15.874; 10.403; 8.359
90; 90.17; 90		510.793Eckert, H.; Fild, C.; Gruehn, R.; Albert, B.; Hofmann, K.; Schleifer, M.
"Na B15": a new structural description based on X-ray and neutron diffraction, electron microscopy, and solid-state NMR spectroscopy
Chemistry - A European Journal, 2000, 6, 2531-2536
1537280 CIFH8 Li3 Mo9 O41 S8I 4/m14.7749; 14.7749; 11.189
90; 90; 90		2442.53du Peloux, C.; Secheresse, F.; Barboux, P.; Laurent, G.; Dolbecq, A.; Marrot, J.
Octanuclear Oxothiomolybdate (V) Rings: Structure and Ionic Conducting Properties
Chemistry - A European Journal, 2004, 10, 3026-3032
1532734 CIFLi3 N2 ScI a -310.045; 10.045; 10.045
90; 90; 90		1013.56Niewa, R.; Leoni, S.; Zherebtsov, D.A.
Li3 (Sc N2): the first nitridoscandate(III) - tetrahedral Sc coordination and unusual M X2 framework
Chemistry - A European Journal, 2003, 9, 4255-4259
1100220 CIFC11 H12 Cl N O2I b a 211.0478; 28.024; 7.2693
90; 90; 90		2250.6Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal, 2001, 7, 2581-2594
1510535 CIFAu4 Cd K2 S4I b a m10.568; 6.973; 14.69
90; 90; 90		1082.52Axtell, E.A.; Kanatzidis, M.G.
First examples of gold thiocadmates: A2 Au2 Cd2 S4 (A = rb, Cs) andK2 Au4 Cd S4 : bright photoluminescence from new alkali metal/gold thiocadmates
Chemistry - A European Journal, 1998, 4, 2435-2441
1536390 CIFIn5.64 La Ni7.36I b a m8.066; 9.248; 12.465
90; 90; 90		929.819Kal'ichak, Ya.M.; Zaremba, V.I.; Galadzhun, Ya.V.; Miliyanchuk, Kh.Yu.; Hoffmann, R.D.; Poettgen, R.
New [Ni7] Cluster in LaNi7In6 and Distorted bcc Indium Cubes in LaNiIn4
Chemistry - A European Journal, 2001, 7, 5343-5349
1510132 CIFAu Eu SnI m m 24.791; 38.336; 8.201
90; 90; 90		1506.26Mosel, B.D.; Muellmann, R.; Kotzyba, G.; Hoffmann, R.; Poettgen, R.
A five-fold superstructure of the K Hg2-type, realized for the new stannide Eu Au Sn
Chemistry - A European Journal, 1997, 3, 1852-1859
1535148 CIFAs Cu F7I m m a10.732; 6.941; 6.814
90; 90; 90		507.58Mazej, Z.; Arcon, I.; Benkic, P.; Tressaud, A.; Kodre, A.
Compressed octahedral coordination in chain compounds containing divalent copper: Structure and magnetic properties of CuFAsF6 and CsCuAlF6
Chemistry - A European Journal, 2004, 10, 5052-5058
1004028 CIFC10 H30 Co4 Ga6 N4 O41 P10P -19.848; 12.47; 12.603
63.47; 74.56; 76.03		1321.2Josien, L.; Simon-Masseron, A.; Gramlich, V.; Patarin, J.; Rouleau, L.
Synthesis and crystal structure of IM-6, a new open framework cobalt-gallium phosphate with 10- and 12-membered pore openings
Chemistry - A European Journal, 2003, 9, 856-861
1004032 CIFC12 H43 F6 Ga5 N4 O22 P4P -18.735; 8.864; 12.636
98.36; 100.18; 115.84		838.9Josien, L.; Simon, A.; Gramlich, V.; Patarin, J.
Hydrothermal synthesis and characterization of the new layered fluorogallophosphate Mu-23
Chemistry - A European Journal, 2002, 8, 1614-1620
1100192 CIFC47.5 H35 Cl2 O P2 RhP -110.966; 13.868; 14.306
79.09; 74.83; 74.74		2008.75Breit, Bernhard; Winde, Roland; Mackewitz, Thomas; Paciello, Rocco; Harms, Klaus
Phosphabenzenes as Monodentate π-Acceptor Ligands for Rhodium-Catalyzed Hydroformylation
Chemistry - A European Journal, 2001, 7
1100200 CIFC28 H74 Cu2 Li2 O3 Si4P -110.8446; 10.9136; 18.9558
87.682; 81.637; 82.658		2200.89John, Michael; Auel, Carsten; Behrens, Christoph; Marsch, Michael; Harms, Klaus; Bosold, Ferdinand; Gschwind, Ruth M.; Rajamohanan, Pattuparambil R.; Boche, Gernot
The Relation between Ion Pair Structures and Reactivities of Lithium Cuprates
Chemistry - A European Journal, 2000, 6, 3060-3068
1100224 CIFC11 H19 N O3P -15.6138; 7.0575; 15.9015
96.654; 95.454; 109.173		585.075Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal, 2001, 7, 2581-2594
1100226 CIFC16 H27 N O3P -19.3539; 9.4338; 10.2406
91.805; 104.889; 109.986		813.611Bach, Thorsten; Schlummer, Björn; Harms, Klaus
Intramolecular Iron(II)-catalyzed Nitrogen Transfer Reactions of Unsaturated Alkoxycarbonyl Azides: A Facile and Stereoselective Route to 4,5-Disubstituted Oxazolidinones
Chemistry - A European Journal, 2001, 7, 2581-2594
1100229 CIFC19 H18 Cl3 N O2P -17.699; 13.7214; 18.8308
89.963; 80.265; 76.44		1904.43Bach, Thorsten; Bergmann, Hermann; Brummerhop, Harm; Lewis, Warren; Harms, Klaus
The [2+2]-Photocycloaddition of Aromatic Aldehydes and Ketones to 3,4-Dihydro-2-pyridones: Regioselectivity, Diastereoselectivity, and Reductive Ring Opening of the Product Oxetanes
Chemistry - A European Journal, 2001, 7, 4512-4521
1100644 CIFC30 H40 Cl2 N2 O6 Zn2P -18.6024; 10.1643; 10.2254
86.61; 79.601; 69.707		824.81Boche, Gernot; Bosold, Ferdinand; Hermann, Holger; Marsch, Michael; Harms, Klaus; Lohrenz, J. C. W.
Crystal Structure of [2-ZnCl-benzoxazole·2 THF]~2~: The Remarkable Difference between 2-ZnHal- and 2-Li-oxazoles
Chemistry - A European Journal, 1998, 4, 814-817
1509324 CIFAg F30 O6 S16 Sb Te6P -110.756; 10.905; 10.456
95.96; 108.94; 81.29		1144.69Decken, A.; Passmore, J.; Krossing, I.; Cameron, T.S.; Min Fang; Dionne, I.
Approaching the gas phase structures of AgS8+ and AgS16+ in the solid state
Chemistry - A European Journal, 2002, 8, 3386-3401
1509815 CIFAg2 As6 K10 Mo6 O173 S8 W36P -113.1872; 20.9825; 21.9243
110.113; 96.327; 100.665		5497.87Marrot, J.; Cadot, E.; Duval, S.; Simonnet-Jegat, C.; Sokolov, M.; Pilette, M.A.
Selective inclusion of Cu(+) and Ag(+) electron - rich metallic cations within supramolecular polyoxometalates based on {As W9 O33} {Mo3 S4} combinations
Chemistry - A European Journal, 2008, 14, 3457-3466
1535230 CIFH9 O15 P3 Zn2.5P -18.475; 9.869; 9.889
112.06; 111.97; 96.99		677.004Herschke, L.; Enkelmann, V.; Lieberwirth, I.; Wegner, G.
The role of hydrogen bonding in the crystal structures of zinc phosphate hydrates
Chemistry - A European Journal, 2004, 10, 2795-2803
1536833 CIFNa4 O158 P4 W30 Y4P -112.8306; 14.9701; 21.702
79.23; 89.227; 86.51		4087.39Fang Xikui; Hill, C.L.; Anderson, T.M.; Benelli, C.
Polyoxometalate-supported Y- and YbIII-hydroxo/oxo clusters from carbonate-assisted hydrolysis
Chemistry - A European Journal, 2005, 11, 712-718
1536896 CIFH2 O140 P4 Ti2 W30P -112.743; 12.759; 19.77
91.843; 93.491; 105.881		3081.95Kortz, U.; Nasser, N.A.; Hamzeh, S.S.
Supramolecular Structures of Ti(IV)-Substituted Wells-Dawson Polyoxotungstates
Chemistry - A European Journal, 2003, 9, 2945-2952
1536899 CIFH6 K2 O174 P4 Ti6 W30P -125.085; 25.085; 49.367
90; 90; 90		31064.5Kortz, U.; Hamzeh, S.S.; Nasser, N.A.
Supramolecular Structures of Ti(IV)-Substituted Wells-Dawson Polyoxotungstates
Chemistry - A European Journal, 2003, 9, 2945-2952

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