Crystallography Open Database

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2105291 CIF
Paper
C14 H14 N2 Ni O11P 1 21/c 113.6825; 10.0465; 13.777
90; 115.166; 90
1714.04Sanotra, Sumit; Gupta, Rimpy; Sheikh, Haq Nawaz; Kalsotra, Bansi Lal; Gupta, Vivek K.; Rajnikant
Hydrothermal synthesis and crystal structure of novel bis(6-carboxypyridine-2-carboxylato-κ^3^<i>O</i>^2^,<i>N</i>,<i>O</i>^6^)nickel(II) trihydrate, Ni(Hpydc)~2~·3H~2~O
Acta Crystallographica Section B, 2012, 68, 619-624
2105292 CIF
HKL
Paper
C5 H11 Cl2 Mn N O3P 21 21 217.0862; 10.0235; 13.2437
90; 90; 90
940.68Lamberts, Kevin; Englert, Ulli
Structures from Mn<i>X</i>~2~ and proline: isomorphous racemic compounds and a series of chiral non-isomorphous chain polymers
Acta Crystallographica Section B, 2012, 68, 610-618
2105293 CIF
HKL
Paper
C7 H17 Br2 Mn N O4P 1 21 18.286; 8.256; 9.387
90; 92.172; 90
641.7Lamberts, Kevin; Englert, Ulli
Structures from Mn<i>X</i>~2~ and proline: isomorphous racemic compounds and a series of chiral non-isomorphous chain polymers
Acta Crystallographica Section B, 2012, 68, 610-618
2105294 CIF
HKL
Paper
C5 H15 I2 Mn N O5P 21 21 218.1264; 11.867; 13.727
90; 90; 90
1323.8Lamberts, Kevin; Englert, Ulli
Structures from Mn<i>X</i>~2~ and proline: isomorphous racemic compounds and a series of chiral non-isomorphous chain polymers
Acta Crystallographica Section B, 2012, 68, 610-618
2105295 CIF
HKL
Paper
C10 H22 Cl2 Mn N2 O6P 1 21/c 19.124; 9.034; 10.001
90; 107.704; 90
785.3Lamberts, Kevin; Englert, Ulli
Structures from Mn<i>X</i>~2~ and proline: isomorphous racemic compounds and a series of chiral non-isomorphous chain polymers
Acta Crystallographica Section B, 2012, 68, 610-618
2105296 CIF
HKL
Paper
C10 H22 Br2 Mn N2 O6P 1 21/c 19.3156; 9.1319; 10.0593
90; 106.904; 90
818.76Lamberts, Kevin; Englert, Ulli
Structures from Mn<i>X</i>~2~ and proline: isomorphous racemic compounds and a series of chiral non-isomorphous chain polymers
Acta Crystallographica Section B, 2012, 68, 610-618
2105297 CIF
HKL
Paper
C10 H22 I2 Mn N2 O6P 1 21/c 19.664; 9.4026; 10.0228
90; 104.454; 90
881.91Lamberts, Kevin; Englert, Ulli
Structures from Mn<i>X</i>~2~ and proline: isomorphous racemic compounds and a series of chiral non-isomorphous chain polymers
Acta Crystallographica Section B, 2012, 68, 610-618
2105298 CIF
Paper
C16 H17 N O2P 1 21/n 18.5755; 10.1627; 14.2676
90; 95.249; 90
1238.21Bibila Mayaya Bisseyou, Yvon; Bouhmaida, Nouhza; Guillot, Benoit; Lecomte, Claude; Lugan, Noel; Ghermani, Noureddine; Jelsch, Christian
Experimental and database-transferred electron-density analysis and evaluation of electrostatic forces in coumarin-102 dye
Acta Crystallographica Section B, 2012, 68, 646-660
2105299 CIF
Paper
C2 H4 K O6 PP 1 21 17.842; 4.577; 8.56
90; 100.04; 90
302.5Mermer, Adrian; Starynowicz, Przemysław
Charge-density distribution in potassium dihydrogen phosphoglycolate ‒ a comparison of phosphate and phosphonate groups
Acta Crystallographica Section B, 2012, 68, 625-635
2105300 CIF
Paper
C48 H24.5 B2 N12 O1.25P -110.418; 13.4413; 13.9207
87.564; 77.298; 88.101
1899.35Fulford, Mabel V.; Lough, Alan John; Bender, Timothy P.
The first report of the crystal structure of non-solvated μ-oxo boron subphthalocyanine and the crystal structures of two solvated forms
Acta Crystallographica Section B, 2012, 68, 636-645
2105301 CIF
Paper
C60 H32 B2 Cl4 N12 OP -111.3894; 13.2623; 17.6618
78.347; 85.616; 76.74
2541.89Fulford, Mabel V.; Lough, Alan John; Bender, Timothy P.
The first report of the crystal structure of non-solvated μ-oxo boron subphthalocyanine and the crystal structures of two solvated forms
Acta Crystallographica Section B, 2012, 68, 636-645
2105302 CIF
Paper
C48 H24 B2 N12 OC 1 2/c 125.6932; 8.3375; 20.886
90; 124.401; 90
3691.6Fulford, Mabel V.; Lough, Alan John; Bender, Timothy P.
The first report of the crystal structure of non-solvated μ-oxo boron subphthalocyanine and the crystal structures of two solvated forms
Acta Crystallographica Section B, 2012, 68, 636-645
2105303 CIF
HKL
Paper
C48 H32 N4 O0.5 S3P 1 21 18.9004; 37.195; 11.6645
90; 104.005; 90
3746.8Stöger, Berthold; Kautny, Paul; Lumpi, Daniel; Zobetz, Erich; Fröhlich, Johannes
Solvatomorphism of 9,9'-[1,3,4-thiadiazole-2,5-diylbis(2,3-thiophendiyl-4,1-phenylene)]bis[9<i>H</i>-carbazole]: isostructurality, modularity and order‒disorder theory
Acta Crystallographica Section B, 2012, 68, 667-676
2105304 CIF
HKL
Paper
C52 H34 N4 S3P -18.8595; 11.5099; 21.2526
103.26; 99.338; 101.444
2017.8Stöger, Berthold; Kautny, Paul; Lumpi, Daniel; Zobetz, Erich; Fröhlich, Johannes
Solvatomorphism of 9,9'-[1,3,4-thiadiazole-2,5-diylbis(2,3-thiophendiyl-4,1-phenylene)]bis[9<i>H</i>-carbazole]: isostructurality, modularity and order‒disorder theory
Acta Crystallographica Section B, 2012, 68, 667-676
2105305 CIF
HKL
Paper
C53 H36 N4 S3P -18.9068; 11.651; 21.201
100.671; 100.792; 103.193
2043.5Stöger, Berthold; Kautny, Paul; Lumpi, Daniel; Zobetz, Erich; Fröhlich, Johannes
Solvatomorphism of 9,9'-[1,3,4-thiadiazole-2,5-diylbis(2,3-thiophendiyl-4,1-phenylene)]bis[9<i>H</i>-carbazole]: isostructurality, modularity and order‒disorder theory
Acta Crystallographica Section B, 2012, 68, 667-676
2105306 CIF
HKL
Paper
C52 H40 N4 O3 S3P 1 21/n 112.5233; 11.2845; 29.4786
90; 94.1313; 90
4155.1Stöger, Berthold; Kautny, Paul; Lumpi, Daniel; Zobetz, Erich; Fröhlich, Johannes
Solvatomorphism of 9,9'-[1,3,4-thiadiazole-2,5-diylbis(2,3-thiophendiyl-4,1-phenylene)]bis[9<i>H</i>-carbazole]: isostructurality, modularity and order‒disorder theory
Acta Crystallographica Section B, 2012, 68, 667-676
2105307 CIF
HKL
Paper
C55 H37 N4 S3P 1 21/n 112.6014; 11.481; 30.2953
90; 105.704; 90
4219.4Stöger, Berthold; Kautny, Paul; Lumpi, Daniel; Zobetz, Erich; Fröhlich, Johannes
Solvatomorphism of 9,9'-[1,3,4-thiadiazole-2,5-diylbis(2,3-thiophendiyl-4,1-phenylene)]bis[9<i>H</i>-carbazole]: isostructurality, modularity and order‒disorder theory
Acta Crystallographica Section B, 2012, 68, 667-676
2105308 CIF
HKL
Paper
C46.5 H28 Cl D N4 S3P 1 21/c 115.3042; 10.0019; 47.6862
90; 91.7802; 90
7295.9Stöger, Berthold; Kautny, Paul; Lumpi, Daniel; Zobetz, Erich; Fröhlich, Johannes
Solvatomorphism of 9,9'-[1,3,4-thiadiazole-2,5-diylbis(2,3-thiophendiyl-4,1-phenylene)]bis[9<i>H</i>-carbazole]: isostructurality, modularity and order‒disorder theory
Acta Crystallographica Section B, 2012, 68, 667-676
2105309 CIF
Paper
C13 H19 F6 O2 P PdP 1 21/c 19.3166; 15.4676; 12.6132
90; 119.016; 90
1589.49Hill, Tania N.; Roodt, Andreas; Steyl, Gideon
Electronic influence of β-diketonato-type ligands on the coordination of 1,5-cyclooctadiene to palladium(II) as defined by `Venus fly trap' geometric parameters
Acta Crystallographica Section B, 2013, 69, 36-42
2105310 CIF
HKL
Paper
C13 H19 B F4 O2 PdP c a 2126.2908; 7.1684; 7.7782
90; 90; 90
1465.9Hill, Tania N.; Roodt, Andreas; Steyl, Gideon
Electronic influence of β-diketonato-type ligands on the coordination of 1,5-cyclooctadiene to palladium(II) as defined by `Venus fly trap' geometric parameters
Acta Crystallographica Section B, 2013, 69, 36-42
2105311 CIF
Paper
C16 H16 F9 O2 P Pd SP 1 21/c 19.9691; 17.0294; 13.6427
90; 124.439; 90
1910.15Hill, Tania N.; Roodt, Andreas; Steyl, Gideon
Electronic influence of β-diketonato-type ligands on the coordination of 1,5-cyclooctadiene to palladium(II) as defined by `Venus fly trap' geometric parameters
Acta Crystallographica Section B, 2013, 69, 36-42
2105312 CIF
Paper
C16 H16 B F7 O2 Pd SP 1 21/c 110.0528; 16.6333; 13.16
90; 125.684; 90
1787.35Hill, Tania N.; Roodt, Andreas; Steyl, Gideon
Electronic influence of β-diketonato-type ligands on the coordination of 1,5-cyclooctadiene to palladium(II) as defined by `Venus fly trap' geometric parameters
Acta Crystallographica Section B, 2013, 69, 36-42
2105313 CIF
HKL
Paper
C13 H13 F12 O2 P PdP 1 21/c 18.5885; 10.6304; 19.4093
90; 93.415; 90
1768.91Hill, Tania N.; Roodt, Andreas; Steyl, Gideon
Electronic influence of β-diketonato-type ligands on the coordination of 1,5-cyclooctadiene to palladium(II) as defined by `Venus fly trap' geometric parameters
Acta Crystallographica Section B, 2013, 69, 36-42
2105314 CIF
HKL
Paper
C40 H26 F10 N6 O6 S2 ZnP -110.0901; 20.3099; 22.312
65.5992; 88.3686; 89.7419
4162.14Dumitru, Florina; Legrand, Yves-Marie; Barboiu, Mihail; van der Lee, Arie
Weak intermolecular hydrogen and halogen interactions in an isomorphous halogen series of pseudoterpyridine Zn^II^ complexes
Acta Crystallographica Section B, 2013, 69, 43-54
2105315 CIF
HKL
Paper
C40 H26 Cl4 F6 N6 O6 S2 ZnP -110.2008; 10.279; 21.6355
93.942; 91.113; 90.349
2262.7Dumitru, Florina; Legrand, Yves-Marie; Barboiu, Mihail; van der Lee, Arie
Weak intermolecular hydrogen and halogen interactions in an isomorphous halogen series of pseudoterpyridine Zn^II^ complexes
Acta Crystallographica Section B, 2013, 69, 43-54
2105316 CIF
HKL
Paper
C40 H26 Br4 F6 N6 O6 S2 ZnP -110.2631; 10.4481; 22.1315
83.959; 88.508; 89.483
2359.1Dumitru, Florina; Legrand, Yves-Marie; Barboiu, Mihail; van der Lee, Arie
Weak intermolecular hydrogen and halogen interactions in an isomorphous halogen series of pseudoterpyridine Zn^II^ complexes
Acta Crystallographica Section B, 2013, 69, 43-54
2105317 CIF
HKL
Paper
C40 H26 F6 I4 N6 O6 S2 ZnP -113.3328; 14.3957; 14.6008
95.972; 110.04; 99.907
2552.9Dumitru, Florina; Legrand, Yves-Marie; Barboiu, Mihail; van der Lee, Arie
Weak intermolecular hydrogen and halogen interactions in an isomorphous halogen series of pseudoterpyridine Zn^II^ complexes
Acta Crystallographica Section B, 2013, 69, 43-54
2105318 CIF
Paper
C60 H40 N8 O16P 1 21/n 110.687; 22.4852; 22.6756
90; 101.721; 90
5335.31Mocilac, Pavle; Gallagher, John F.
Entry point into new trimeric and tetrameric imide-based macrocyclic esters derived from isophthaloyl dichloride and methyl 6-aminonicotinate
Acta Crystallographica Section B, 2013, 69, 62-69
2105319 CIF
Paper
C45 H30 N6 O12P -116.3411; 16.5747; 17.4806
87.273; 83.35; 89.825
4697.4Mocilac, Pavle; Gallagher, John F.
Entry point into new trimeric and tetrameric imide-based macrocyclic esters derived from isophthaloyl dichloride and methyl 6-aminonicotinate
Acta Crystallographica Section B, 2013, 69, 62-69
2105320 CIF
Paper
C10 H13 Cl N2 O3 SP 21 21 2126.573; 4.8587; 8.8165
90; 90; 90
1138.3Seryotkin, Yury V.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
A high-pressure polymorph of chlorpropamide formed on hydrostatic compression of the α-form in saturated ethanol solution
Acta Crystallographica Section B, 2013, 69, 77-85
2105321 CIF
Paper
C10 H13 Cl N2 O3 SP 21 21 2126.5733; 4.7178; 8.6406
90; 90; 90
1083.25Seryotkin, Yury V.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
A high-pressure polymorph of chlorpropamide formed on hydrostatic compression of the α-form in saturated ethanol solution
Acta Crystallographica Section B, 2013, 69, 77-85
2105322 CIF
Paper
C10 H13 Cl N2 O3 SP 21 21 2126.605; 4.6688; 8.5711
90; 90; 90
1064.65Seryotkin, Yury V.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
A high-pressure polymorph of chlorpropamide formed on hydrostatic compression of the α-form in saturated ethanol solution
Acta Crystallographica Section B, 2013, 69, 77-85
2105323 CIF
Paper
C10 H13 Cl N2 O3 SP 21 21 2126.6068; 4.6576; 8.5556
90; 90; 90
1060.24Seryotkin, Yury V.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
A high-pressure polymorph of chlorpropamide formed on hydrostatic compression of the α-form in saturated ethanol solution
Acta Crystallographica Section B, 2013, 69, 77-85
2105324 CIF
Paper
C10 H13 Cl N2 O3 SP 21 1 125.602; 4.634; 8.8525
99.109; 90; 90
1037.01Seryotkin, Yury V.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
A high-pressure polymorph of chlorpropamide formed on hydrostatic compression of the α-form in saturated ethanol solution
Acta Crystallographica Section B, 2013, 69, 77-85
2105325 CIF
Paper
C10 H13 Cl N2 O3 SP 21 1 125.522; 4.6023; 8.8298
99.477; 90; 90
1023Seryotkin, Yury V.; Drebushchak, Tatiana N.; Boldyreva, Elena V.
A high-pressure polymorph of chlorpropamide formed on hydrostatic compression of the α-form in saturated ethanol solution
Acta Crystallographica Section B, 2013, 69, 77-85
2105326 CIF
HKL
Paper
C28 H30 N2 O6 P2P 1 21/c 115.7039; 5.3299; 16.932
90; 111.26; 90
1320.8Gholivand, Khodayar; Valmoozi, Ali A. Ebrahimi; Mahzouni, Hamid R.
Structural and electronic aspects of hydrogen bonding in two polymorphs of butylene-<i>N</i>,<i>N</i>'-bis(<i>O</i>,<i>O</i>'-diarylphosphoramidate)
Acta Crystallographica Section B, 2013, 69, 55-61
2105327 CIF
HKL
Paper
C28 H30 N2 O6 P2P 1 21/n 19.6437; 14.3801; 10.3503
90; 113.659; 90
1314.7Gholivand, Khodayar; Valmoozi, Ali A. Ebrahimi; Mahzouni, Hamid R.
Structural and electronic aspects of hydrogen bonding in two polymorphs of butylene-<i>N</i>,<i>N</i>'-bis(<i>O</i>,<i>O</i>'-diarylphosphoramidate)
Acta Crystallographica Section B, 2013, 69, 55-61
2105328 CIF
Paper
C3 H8 N2 OF d d 211.3837; 19.6293; 4.56079
90; 90; 90
1019.13Näther, Christian; Döring, Cindy; Jess, Inke; Jones, Peter G.; Taouss, Christina
Thermodynamic and structural relationships between the two polymorphs of 1,3-dimethylurea
Acta Crystallographica Section B, 2013, 69, 70-76
2105329 CIF
HKL
Paper
C3 H8 N2 OP 21 21 210.8522; 4.9102; 4.5766
90; 90; 90
243.87Näther, Christian; Döring, Cindy; Jess, Inke; Jones, Peter G.; Taouss, Christina
Thermodynamic and structural relationships between the two polymorphs of 1,3-dimethylurea
Acta Crystallographica Section B, 2013, 69, 70-76
2105330 CIFC2 H3 F2 N OP 1 21/c 15.143; 12.809; 7.037
90; 128.3; 90
363.8D. O. Hughes; R. W. H. Small
The Crystal and Molecular Structure of Difluoroacetamide
Acta Crystallographica Sect. B, 1972, 28, 2520-2524
2105331 CIFAg0.11 Al11 Cd0.555 O17.11P 63/m m c5.59; 5.59; 22.396
90; 90; 120
606.073Thomas, J.O.; Farrington, G.C.; Edstroem, K.
A single-crystal x-ray diffraction study of the ion exchange of Cd2+ into Ag+ beta-alumina
Acta Crystallographica B (39,1983-), 1991, 47, 643-650
2105332 CIFAg0.81 Al11 Cd0.205 O17.11P 63/m m c5.5959; 5.5959; 22.458
90; 90; 120
609.034Edstroem, K.; Thomas, J.O.; Farrington, G.C.
A single-crystal x-ray diffraction study of the ion exchange of Cd2+ into Ag+ beta-alumina
Acta Crystallographica B (39,1983-), 1991, 47, 643-650
2105333 CIFAg0.96 Mg16 Zn31.04P 63/m m c5.21; 5.21; 34.4
90; 90; 120
808.657Komura, Y.; Tokunaga, K.
Structural studies of stacking variants in Mg-base Friauf-Laves-phases
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1548-1554
2105334 CIFAg0.2 Mg Zn1.8R -3 m :H5.21; 5.21; 90.3
90; 90; 120
2122.73Kitano, Y.; Komura, Y.
Long-period stacking variants and their electron-concentration dependence in the Mg-base friauf-laves phases
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 2496-2501
2105335 CIFAg0.23 Al11 Cd0.495 O17.11P 63/m m c5.5896; 5.5896; 22.434
90; 90; 120
607.014Thomas, J.O.; Edstroem, K.; Farrington, G.C.
A single-crystal x-ray diffraction study of the ion exchange of Cd2+ into Ag+ beta-alumina
Acta Crystallographica B (39,1983-), 1991, 47, 643-650
2105336 CIFAg0.37 Cr1.21 S2R -3 m :H3.4325; 3.4325; 37.19
90; 90; 120
379.47Bronsema, K.D.; Wiegers, G.A.
Structure of a non-stoichiometric chromium silver sulphide
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2229-2232
2105337 CIFAg BaP n m a8.657; 4.982; 6.651
90; 90; 90
286.852Merlo, F.; Fornasini, M.L.
The structures of alpha-Ca Cu, beta-Ca Cu, Sr Ag and Ba Ag: Four different stacking variants based on noble-metal- centred trigonal prisms
Acta Crystallographica B (24,1968-38,1982), 1981, 37, 500-503
2105338 CIFAg Bi Cr2 O8I -45.1064; 5.1064; 11.9091
90; 90; 90
310.534Riou, A.; Roult, G.
Etude par diffraction neutronique en tempy de vol de la structure cristalline
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 2494-2499
2105339 CIFAg Bi Cr4 O14I 48.4944; 8.4944; 8.1313
90; 90; 90
586.713Roult, G.; Riou, A.
Etude par Diffraction X et par Diffraction Neutronique en Temps de Vol de la Structure de Ag Bi (Cr2 O7)2
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1327-1331
2105340 CIF
Paper
Al4 Ca0.03 K0.54 Na3.24 O16 Si4X3(00\g)017.2889; 17.2889; 8.3622
90; 90; 120
2164.6Friese, Karen; Grzechnik, Andrzej; Petříček, Vaclav; Schönleber, Andreas; van Smaalen, Sander; Morgenroth, Wolfgang
Modulated structure of nepheline
Acta Crystallographica Section B, 2011, 67, 18-29
2105341 CIFAg Fe O2P 63/m m c3.039; 3.039; 12.395
90; 90; 120
99.138Okamoto, S.; Okamoto, S.I.; Ito, T.
The crystal structure of a new hexagonal phase of Ag Fe O2
Acta Crystallographica B (24,1968-38,1982), 1972, 28, 1774-1777
2105342 CIFAg IP 63 m c4.5979; 4.5979; 15.029
90; 90; 120
275.156Schock, R.N.; Johnson, Q.
The 4h polytype of silver iodide
Acta Crystallographica B (24,1968-38,1982), 1975, 31, 1482-1483
2105343 CIFAg I3 K2P n m a10.01; 4.78; 19.32
90; 90; 90
924.419Thackeray, M.M.; Coetzer, J.
Dipotassium silver triiodide
Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2339-2340
2105344 CIFAg La O SP 4/n m m :24.05; 4.05; 9.039
90; 90; 90
148.262Palazzi, M.; Jaulmes, S.
Structure du conducteur ionique La O Ag Y
Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1337-1339
2105345 CIFAg Mn O4P 1 21/n 15.64; 8.33; 7.12
90; 92.25; 90
334.248Boonstra, E.G.
The crystal structure of silver permanganate
Acta Crystallographica B (24,1968-38,1982), 1968, 24, 1053-1062
2105346 CIFAg N O2I m m 23.528; 6.172; 5.181
90; 90; 90
112.815Saito, Y.; Ohba, S.
Structure of silver(I) nitrite, a redetermination
Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1911-1913
2105347 CIFAg N O3R 3 m :H5.196; 5.196; 8.49
90; 90; 120
198.507Capponi, J.J.; Meyer, P.
Structure d'une phase 'haute temperature' du nitrate d'argent
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2543-2546
2105348 CIFAg N O3P 21 21 2110.125; 7.335; 6.992
90; 90; 90
519.274Meyer, P.; Rimsky, A.; Chevalier, R.
Structure du nitrate d'argent a pression et temperature ordinaires. Exemple de cristal parfait
Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1457-1462
2105349 CIFAg N O3R 3 c :H5.16; 5.16; 16.58
90; 90; 120
382.309Chevalier, R.; Meyer, P.; Rimsky, A.
Structure d une phase du nitrate d argent instable a temperature et pression ordinaires
Acta Crystallographica B (24,1968-38,1982), 1976, 32, 1143-1146
2105350 CIFAg N2 Na O4F d d d :18.089; 10.573; 10.744
90; 90; 90
918.881Saito, Y.; Ishihara, M.; Ohba, S.
Temperature dependence of disorder of nitrite ions in Ag Na (N O2)2.
Acta Crystallographica B (39,1983-), 1987, 43, 160-164
2105351 CIFAg P S3C 1 2/m 111.21; 6.998; 8.972
90; 143.1; 90
422.595Khodadad, P.; Rodier, N.; Toffoli, P.
Structure cristalline de l'hexathiodimetaphosphate d'argent, Ag2 P2 S6
Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3561-3564
2105352 CIFAg SrP n m a16.558; 4.788; 6.385
90; 90; 90
506.201Merlo, F.; Fornasini, M.L.
The structures of alpha-Ca Cu, beta-Ca Cu, Sr Ag and Ba Ag: Four different stacking variants based on noble-metal- centered trigonal prisms
Acta Crystallographica B (24,1968-38,1982), 1981, 37, 500-503
2105353 CIFAg1.12 Al11 Cd0.05 O17.11P 63/m m c5.6032; 5.6032; 22.504
90; 90; 120
611.875Farrington, G.C.; Edstroem, K.; Thomas, J.O.
A single-crystal x-ray diffraction study of the ion exchange of Cd2+ into Ag+ beta-alumina
Acta Crystallographica B (39,1983-), 1991, 47, 643-650
2105354 CIFAg1.15 Mg9 Zn16.85R -3 m :H5.21; 5.21; 38.7
90; 90; 120
909.739Komura, Y.; Tokunaga, K.
Structural studies of stacking variants in Mg-base Friauf-Laves-phases
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1548-1554
2105355 CIFAg1.22 Al11 O17.11P 63/m m c5.5914; 5.5914; 22.43
90; 90; 120
607.297Edstroem, K.; Thomas, J.O.; Farrington, G.C.
A single-crystal x-ray diffraction study of the ion exchange of Cd2+ into Ag+ beta-alumina
Acta Crystallographica B (39,1983-), 1991, 47, 643-650
2105356 CIFAg2 Mo3 O12 Zn2P -16.992; 8.712; 10.818
64.24; 66.51; 76.27
542.659Mayer, M.; Perez, G.; Gicquel-Mayer, C.
Etude Structurale du Molybdate Double d'Argent et de Zinc Ag2 Zn2 Mo3 O12
Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1035-1039
2105357 CIFAg2 O3 SnP 21 21 2129.21999; 12.67; 5.62
90; 90; 90
2080.62Carlsson, A.; Linke, C.; Svensson, C.; Bovin, J.O.; Oku, T.; Wallenberg, L.R.; Jansen, M.
Modulated structure of Ag2 Sn O3 studied by high-resolution electron microscopy
Acta Crystallographica B (39,1983-), 2000, 56, 363-368
2105358 CIFAg2 P S3P 1 21/c 120.291; 11.797; 19.616
90; 161.3; 90
1505.45Michelet, A.; Khodadad, P.; Rodier, N.; Toffoli, P.
Structure de l'hexathiodiphosphate(IV) d'argent
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 706-710
2105359 CIFAg2.868 I SP m -3 m4.987; 4.987; 4.987
90; 90; 90
124.028Schulz, H.; Beyeler, H.U.; Perenthaler, E.
Structures and Phase Transition of beta- and gamma-Ag3 I S
Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1017-1023
2105360 CIFAg2 Br N O3P n m a6.8461; 5.132; 12.8232
90; 90; 90
450.533Holmberg, B.; Persson, K.
The crystal structure of Ag2 Br N O3
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3768-3772
2105361 CIFAg2 Cl N O3P n m a6.6566; 5.1113; 12.4887
90; 90; 90
424.914Persson, K.
Structure of disilver chloride nitrate
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1432-1435
2105362 CIFAg2 Hg I2 N2 O6P b a m10.947; 18.968; 5.3127
90; 90; 90
1103.14Holmberg, B.; Persson, K.
Structure of Mercury Disilver Diiodide Dinitrate Monohydrate
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 904-907
2105363 CIFAg2 I N O3P 21 21 217.4354; 7.7759; 17.1338
90; 90; 90
990.624Persson, K.
The crystal structure of Ag2 I N O3
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 302-306
2105364 CIFAg3.63 GdP 6/m12.67; 12.67; 9.332
90; 90; 120
1297.35Kline, G.R.; Bailey, D.M.
The crystal structure of Gd Ag3.6
Acta Crystallographica B (24,1968-38,1982), 1971, 27, 650-653
2105365 CIFAg4 LuI 4/m6.6696; 6.6696; 4.1581
90; 90; 90
184.967McMasters, O.D.; Gschneidner, K.A.jr.; Venteicher, R.F.
Crystallography of the silver-rich rare earth-silver intermetallic compounds
Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1224-1229
2105366 CIFAg4 Mn S6 Sb2P 1 21/n 110.31; 8.07; 6.62
90; 90; 90
550.795Synecek, V.; Hruskova, J.
The crystal structure of samsonite, (Ag2 S)2 (Mn S) (Sb2 S3)
Acta Crystallographica B (24,1968-38,1982), 1969, 25, 1004-1006
2105367 CIFAg4 N2 O2 SP n a 2110.42; 5.78; 8.95
90; 90; 90
539.037Kratky, C.; Popitsch, A.
Structure of Tetrasilver(I) Sulfamide
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 1044-1048
2105368 CIFAg4 N2 O6 TeP 21 38.627; 8.627; 8.627
90; 90; 90
642.066Bergerhoff, G.; Schultze-Rhonhof, E.
Die Kristallstruktur des beta-Tetraargentotellurnitrates, beta-Ag4 Te (N O3)2
Acta Crystallographica B (24,1968-38,1982), 1969, 25, 2645-2648
2105369 CIFAg4 N2 O6 TeP a -38.173; 8.173; 8.173
90; 90; 90
545.939Schultze-Rhonhof, E.
Die Kristallstruktur von alpha-Tetrasilbertelluriddinitrat
Acta Crystallographica B (24,1968-38,1982), 1975, 31, 2837-2840
2105370 CIFAg4 P2 S6P 1 1 21/b6.522; 19.616; 11.797
90; 90; 93.58
1506.31Michelet, A.; Toffoli, P.; Khodadad, P.; Rodier, N.
Structure de l'Hexathiodiphosphate(IV) d'Argent
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 706-710
2105371 CIFAg4 P2 S7C 1 2/c 116.672; 6.534; 16.211
90; 141.7; 90
1094.49Khodadad, P.; Toffoli, P.; Rodier, N.
Structure cristalline du pyrothiophosphate d'argent, Ag4 P2 S7
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1492-1494
2105372 CIFAg4 P2 S7B 1 1 2/b10.778; 16.211; 6.534
90; 90; 106.8
1092.91Khodadad, P.; Rodier, N.; Toffoli, P.
Structure cristalline du pyrothiophosphate d'argent, Ag4 P2 S7
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1492-1494
2105373 CIFAg4 P2 Se6P 21 21 2114.169; 11.598; 6.585
90; 90; 90
1082.13Rodier, N.; Toffoli, P.; Khodadad, P.
Structure cristalline de l'hexaselenohypodiphosphate d'argent, Ag4 P2 Se6
Acta Crystallographica B (24,1968-38,1982), 1978, 34, 1779-1781
2105374 CIFAg4 ScI 4/m6.574; 6.574; 4.0686
90; 90; 90
175.835Venteicher, R.F.; Gschneidner, K.A.jr.; McMasters, O.D.
Crystallography of the silver-rich rare earth-silver intermetallic compounds
Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1224-1229
2105375 CIFAg5 EuP 6/m m m5.6201; 5.6201; 4.6439
90; 90; 120
127.029Gschneidner, K.A.jr.; McMasters, O.D.J.; Venteicher, R.F.
Crystallography of the silver-rich rare earth-silver intermetallic compounds
Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1224-1229
2105376 CIFAg5 LaP 63/m m c5.569; 5.569; 9.0775
90; 90; 120
243.81McMasters, O.D.; Venteicher, R.F.; Gschneidner, K.A.jr.
Crystallography of the silver-rich rare earth-silver intermetallic compounds
Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1224-1229
2105377 CIFAg6 O7 Si2P 1 2/n 110.264; 5.259; 8.052
90; 110.5; 90
407.109Jansen, M.
Silber(I)-disilikat
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 3584-3586
2105378 CIFAg7.15 P3 S11B 1 1 2/b23.97; 24.88; 6.361
90; 90; 110.85
3545.11Khodadad, P.; Rodier, N.; Toffoli, P.
Structure du tetrathiomonophosphate(V) heptathiodiphosphate(V) d'argent
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2374-2378
2105379 CIFAg8 Ge Se6P m n 217.823; 7.712; 10.885
90; 90; 90
656.703Carre, D.; Ollitrault-Fichet, R.; Flahaut, J.
Structure de Ag8 Ge Se6 beta
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 245-249
2105380 CIFAg8 Ge Te6F -4 3 m11.566; 11.566; 11.566
90; 90; 90
1547.21Laruelle, P.; Katty, A.; Rysanek, N.
Structure cristalline de Ag8 Ge Te6 (gamma)
Acta Crystallographica B (24,1968-38,1982), 1976, 32, 692-696
2105381 CIFAg8 O4 S2 SiI 41/a m d :27.005; 7.005; 17.75
90; 90; 90
870.993Schultze-Rhonhof, E.
Die Kristallstruktur des Silbersulfidorthosilicates, Ag8 S2 Si O4
Acta Crystallographica B (24,1968-38,1982), 1974, 30, 2553-2558
2105382 CIFAg8 SI m m 25.9; 6.4; 8.7
90; 90; 90
328.512Hashimoto, H.; Yu, Y.-D.; Guan, R.; Makita, Y.
Electron-microscope study of the structure of Ag8 S formed in the initial stage of silver sulfidation
Acta Crystallographica B (39,1983-), 1995, 51, 149-155
2105383 CIFAg9 Ga Se6P 21 311.126; 11.126; 11.126
90; 90; 90
1377.26Loiseleur, H.; Faure, R.; Roubin, M.; Deloume, J.P.
Structure cristalline de la phase Ag9 Ga Se6-beta
Acta Crystallographica B (24,1968-38,1982), 1978, 34, 3189-3193
2105384 CIFAg9 In4P -4 3 m9.922; 9.922; 9.922
90; 90; 90
976.782Tozer, D.J.N.; Brezard, R.; Pearson, W.B.; Brandon, J.K.
Gamma-brasses with I and P cells
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 527-537
2105385 CIFAg3 Te2 TlC m m m4.6; 15.45; 4.76
90; 90; 90
338.293Gelato, L.M.; Penzo, M.; Parthe, E.; Cenzual, K.
Inorganic structure types with revised space groups.I.
Acta Crystallographica B (39,1983-), 1991, 47, 433-439
2105386 CIFAg3 TmP m -3 m4.2117; 4.2117; 4.2117
90; 90; 90
74.709Venteicher, R.F.; McMasters, O.D.; Gschneidner, K.A.jr.
Crystallography of the silver-rich rare earth-silver intermetallic compounds
Acta Crystallographica B (24,1968-38,1982), 1970, 26, 1224-1229
2105387 CIFAu Cl OR -3 :R8.148; 8.148; 8.148
113.45; 113.45; 113.45
341.64Rumpel, H.; Schwarzmann, E.; Jones, P.G.; Sheldrick, G.M.
Gold(III) chloride oxide
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 2380-2381
2105388 CIFAu Cl4 KP 1 c 18.671; 6.386; 12.243
90; 95.37; 90
674.956Bonamico, M.; Dessy, G.
The crystal structure of anhydrous potassium tetrachloroaurate(III)
Acta Crystallographica B (24,1968-38,1982), 1973, 29, 1735-1736
2105389 CIFAu V3P m -3 n4.8807; 4.8807; 4.8807
90; 90; 90
116.264van Reuth, E.C.; Waterstrat, R.M.
Atomic ordering in binary A15-type phases
Acta Crystallographica B (24,1968-38,1982), 1968, 24, 186-196
2105390 CIFAu2 O3F d d 212.827; 10.52; 3.838
90; 90; 90
517.9Sheldrick, G.M.; Jones, P.G.; Schwarzmann, E.; Rumpel, H.
Gold(III) oxide
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 1435-1437
2105391 CIFAu2 P3C 1 2/m 15.863; 14.439; 4.674
90; 108.39; 90
375.474Moeller, M.H.; Jeitschko, W.
The crystal structures of Au P3 and Au7 P10 I, polyphosphides with weak Au-Au interactions
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 573-579
2105392 CIFAu3 Sb4 Y3I -4 3 d9.818; 9.818; 9.818
90; 90; 90
946.388Dwight, A.E.
Yttrium-gold-antimony
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 1579-1581
2105393 CIFAu3.96 Cr1.04I 4/m6.398; 6.398; 4.046
90; 90; 90
165.621Watanabe, Y.; Iwasaki, H.
Lattice modulation in the Mo Ni4-type structure of Au4 Cr
Acta Crystallographica B (39,1983-), 1984, 40, 373-376
2105394 CIFAu31 Mn9P 4/m12.6; 12.6; 4
90; 90; 90
635.04Watanabe, D.; Hiraga, K.; Terasaki, O.; Shindo, D.; Hirabayashi, M.
A study of the ordered structures of the Au-Mn system by high-voltage high-resolution microscopy
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2550-2554
2105395 CIFAu41 Mg13P 63/m c m14.927; 14.927; 9.441
90; 90; 120
1821.77Sato, H.; Toth, R.S.; Schubert, K.; Burkhardt, K.
Die Struktur der Phase Au77 Mg23
Acta Crystallographica B (24,1968-38,1982), 1968, 24, 137-142
2105396 CIFAu6 PrC 1 2/c 17.765; 7.745; 9.076
90; 100.3; 90
537.034Moreau, J.M.; Parthe, E.
The crystal structures of the rare-earth hexaaurides R Au6
Acta Crystallographica B (24,1968-38,1982), 1974, 30, 1743-1748
2105397 CIFAu6 SmP 42/n c m :210.395; 10.395; 9.706
90; 90; 90
1048.79Moreau, J.M.; Flack, H.D.; Parthe, E.
Refinement of Sm Au6
Acta Crystallographica B (24,1968-38,1982), 1974, 30, 820-821
2105398 CIFAu7 I P10P -3 1 m6.18; 6.18; 11.122
90; 90; 120
367.867Jeitschko, W.; Moeller, M.H.
The crystal structures of Au P3 and Au7 P10 I, polyphosphides with weak Au-Au interactions
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 573-579
2105399 CIFAu9 In4P -4 3 m9.829; 9.829; 9.829
90; 90; 90
949.572Brandon, J.K.; Pearson, W.B.; Brezard, R.; Tozer, D.J.N.
Gamma-brasses with I and P cells
Acta Crystallographica B (24,1968-38,1982), 1977, 33, 527-537
2105400 CIFB2 Eu O4P n c a6.593; 12.063; 4.343
90; 90; 90
345.405Adachi, G.Y.; Shiokawa, J.; Machida, K.
Structure of Divalent-Europium Metaborate
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 149-151
2105401 CIFB2 K Nb O6P b n 217.3056; 31.1632; 9.1659
90; 90; 90
2086.76Schmid, S.; Wagner, T.
Structure of K Nb O B2 O5 - a commensurately modulated structure
Acta Crystallographica B (39,1983-), 2005, 61, 361-366
2105402 CIFB2 Bi4 O9P 1 21/c 111.107; 6.627; 11.044
90; 91.04; 90
812.772Perloff, A.; Hyman, A.
The crystal structure of bismuth (2/1) borate, (Bi2 O3 B2 O3)2
Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2007-2011
2105403 CIFB2 O3C c m 214.613; 7.803; 4.129
90; 90; 90
148.624Shannon, R.D.; Prewitt, C.T.
Crystal structure of a high-pressure form of B2 O3
Acta Crystallographica B (24,1968-38,1982), 1968, 24, 869-874
2105404 CIFB2 O3P 314.3358; 4.3358; 8.3397
90; 90; 120
135.775Gorres, B.T.; Montgomery, P.W.; Knutson, C.D.; Gurr, G.E.
The crystal structure of trigonal diboron trioxide
Acta Crystallographica B (24,1968-38,1982), 1970, 26, 906-915
2105405 CIFB2 O4 PdI -4 2 d11.672; 11.672; 5.698
90; 90; 90
776.27Schmid, H.; Depmeier, W.
Palladium metaborate
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 605-606
2105406 CIFB2 Ca F8P b c a9.2792; 8.9103; 13.3719
90; 90; 90
1105.59Brown, W.E.; Schroeder, L.W.; Jordan, T.H.; Dickens, B.
The crystal structure of Ca (B F4)2
Acta Crystallographica B (24,1968-38,1982), 1975, 31, 669-672
2105407 CIFB2 Ca O4P n a 2111.38; 6.382; 11.304
90; 90; 90
820.977Remeika, J.P.; Marezio, M.; Dernier, P.D.
The Crystal Structure of the High Pressure Phase Ca B2 O4 (III)
Acta Crystallographica B (24,1968-38,1982), 1969, 25, 955-964
2105408 CIFB2 Ca O4P a -39.008; 9.008; 9.008
90; 90; 90
730.946Marezio, M.; Dernier, P.D.; Remeika, J.P.
The crystal structure of the high pressure phase, Ca B2 O4 (IV), and polymorphism in Ca B2 O4
Acta Crystallographica B (24,1968-38,1982), 1969, 25, 965-970
2105409 CIFB3 Cl6 N3R 3 :H8.847; 8.847; 10.321
90; 90; 120
699.591Groeneveld, W.L.; Verschoor, G.C.; Haasnoot, J.G.; Romers, C.
On the crystal and molecular structure of hexachloroborazine
Acta Crystallographica B (24,1968-38,1982), 1972, 28, 2070-2073
2105410 CIFB3 Cl6 N3R -3 :R6.151; 6.151; 6.151
91.8; 91.8; 91.8
232.37Mueller, U.
Die Kristallstruktur von Hexachloroborazol
Acta Crystallographica B (24,1968-38,1982), 1971, 27, 1997-2003
2105411 CIFB3.76 Ir3 ZrP 63/m7.56; 7.56; 3.512
90; 90; 120
173.832Rogl, P.
The crystal structure of Zr Ir3 B4
Acta Crystallographica B (24,1968-38,1982), 1978, 34, 721-724
2105412 CIFB Cl4 K O12 S4C 1 c 18.147; 20.08499; 10.513
90; 109.32; 90
1623.39Schomaker, V.; Marsh, R.E.
Potassium tetrachlorosulfatoborate: change in space group
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 219-220
2105413 CIFB Co MoP n m a5.741; 3.232; 6.634
90; 90; 90
123.093Jeitschko, W.
The crystal structure of Mo Co B and related compounds
Acta Crystallographica B (24,1968-38,1982), 1968, 24, 930-934
2105414 CIFB Co NbP m m n :23.266; 17.177; 5.947
90; 90; 90
333.627Shoemaker, D.P.; Kripyakevich, P.I.; Kuz'ma, Yu.B.; Brink-Shoemaker, C.; Voroshilov, Yu.V.
The crystal structure of (Nb Co B)
Acta Crystallographica B (24,1968-38,1982), 1971, 27, 257-261
2105415 CIFB F15 O3 Te3P 63/m9.218; 9.218; 9.207
90; 90; 120
677.52Sawyer, J.F.; Schrobilgen, G.J.D.
Tris(pentafluorotellurato(VI))boron(III)
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 1561-1563
2105416 CIFB Li3 N2P 42/m n m4.6435; 4.6435; 5.2592
90; 90; 90
113.399Penzo, M.; Cenzual, K.; Gelato, L.M.; Parthe, E.
Inorganic structure types with revised space groups.I.
Acta Crystallographica B (39,1983-), 1991, 47, 433-439
2105417 CIFB Nb Ni2 O6P n m a10.057; 8.618; 4.49
90; 90; 90
389.154Modrick, M.A.; Ansell, G.B.; Wondre, F.R.; Wanklyn, B.M.; Leonowicz, M.E.
The Structure of Dinickel Niobium(V) Boron Oxide Ni2 Nb B O6
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 892-893
2105418 CIFB10 Cu15 O30P -13.353; 19.665; 19.627
88.77; 69.71; 69.24
1127.41Behm, H.
Pentadecacopper(II) Bisdiborate Hexaorthoborate Dioxide
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2781-2784
2105419 CIFB10 O21 Pb6P -16.833; 7.01; 11.125
85.89; 102; 119.56
453.092Krogh-Moe, J.; Wold-Hansen, P.S.
The crystal structure of hexalead pentaborate, (Pb O)6 (B2 O3)5
Acta Crystallographica B (24,1968-38,1982), 1973, 29, 2242-2246
2105420 CIFB12.64 P1.36R -3 m :R5.231; 5.231; 5.231
69.5; 69.5; 69.5
121.285Amberger, E.; Rauh, P.A.
Struktur des borreichen Borphosphids
Acta Crystallographica B (24,1968-38,1982), 1974, 30, 2549-2553
2105421 CIFB0.996 Na0.209 O26 P6 Sr9.402P -39.734; 9.734; 7.279
90; 90; 120
597.29Calvo, C.; Faggiani, R.; Krishnamachari, N.
The crystal structure of sodium strontium boron dioxide hexaphosphate - a deviant apatite
Acta Crystallographica B (24,1968-38,1982), 1975, 31, 188-192
2105422 CIFB Ca2 Cl O3P 1 21/c 13.9484; 8.692; 12.402
90; 100.27; 90
418.811Hanic, F.; Zak, Z.
The crystal structure of calcium borate chloride Ca Cl2 Ca3 (B O3)2
Acta Crystallographica B (24,1968-38,1982), 1976, 32, 1784-1787
2105423 CIFB Ca3 Er3 Ge2 O13F -4 3 m10.452; 10.452; 10.452
90; 90; 90
1141.82Remeika, J.P.; Marezio, M.; Cooper, A.S.; Grey, I.E.; Chenavas, J.; Joubert, J.C.; Guitel, J.C.
The structure of calcium erbium germanium borate Ca3 Er3 Ge2 B O13, a sulphohalite-related compound
Acta Crystallographica B (24,1968-38,1982), 1981, 37, 1343-1346
2105424 CIFB4 Lu Rh4C c c a :27.41; 22.26; 7.44
90; 90; 90
1227.2Yvon, K.; Johnston, D.C.
Orthorhombic Lu Rh4 B4 -A new polytype of R T4 B4 stoichiometry
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 247-250
2105425 CIFB4 O7 ZnP b c a13.714; 8.091; 8.631
90; 90; 90
957.696Martinez-Carrera, S.; Martinez-Ripoll, M.; Garcia-Blanco, S.
The crystal structure of zinc diborate, Zn B4 O7
Acta Crystallographica B (24,1968-38,1982), 1971, 27, 672-677
2105426 CIFB50 Ti1.87P 42/n n m :18.83; 8.83; 5.072
90; 90; 90
395.458Amberger, E.; Polbov, K.
Struktur des tetragonalen (B12)4 B2 Ti1.3...2.0
Acta Crystallographica B (24,1968-38,1982), 1975, 31, 949-953
2105427 CIFB50 V1.54P 42/n n m :18.824; 8.824; 5.027
90; 90; 90
391.417Polborn, K.; Amberger, E.
Tetragonales Vanadiumborid (B12)4 B2 V1.5-1.9
Acta Crystallographica B (24,1968-38,1982), 1976, 32, 974-975
2105428 CIFB6 Cs2 O10P 21 21 216.213; 8.521; 9.17
90; 90; 90
485.469Krogh-Moe, J.
Refinement of the crystal structure of cesium triborate, Cs2 O (B2 O3)3
Acta Crystallographica B (24,1968-38,1982), 1974, 30, 1178-1180
2105429 CIFB65.9 YF m -3 c23.44; 23.44; 23.44
90; 90; 90
12878.7Richards, S.M.; Kasper, J.S.
The crystal structure of Y B66
Acta Crystallographica B (24,1968-38,1982), 1969, 25, 237-251
2105430 CIFB7 Br Cr3 O13F -4 3 c12.134; 12.134; 12.134
90; 90; 90
1786.54Yvon, K.; Yoshida, M.; Schmid, H.; Kubel, F.
Cubic structure of chromium-bromine boracite at 298 and 113 K
Acta Crystallographica B (39,1983-), 1992, 48, 30-32
2105431 CIFB7 Cl Cr3 O13P -4 21 c12.141; 12.141; 12.1606
90; 90; 90
1792.52Schmid, H.; Yvon, K.; Kubel, F.; Mao, S.Y.
Tetragonal ferroelastic/antiferroelectric chromium-chlorine boracite, Cr3B7O13Cl, fron x-ray diffraction on a single-domain crystal at 230 K
Acta Crystallographica B (39,1983-), 1991, 47, 692-696
2105432 CIFB8 Ba O13P 41 2 28.56; 8.56; 13.2
90; 90; 90
967.212Ihara, M.; Krogh-Moe, J.
On the crystal structure of barium tetraborate, Ba O (B2 O3)4
Acta Crystallographica B (24,1968-38,1982), 1969, 25, 2153-2154
2105433 CIFB8 Ca H16 K2 O26P 21 21 2116.597; 12.469; 11.569
90; 90; 90
2394.18Domenech, M.V.; Font-Altaba, M.; Solans, X.; Solans, J.
The calcium potassium tetraborate hydrate Ca K2 (B4 O5(O H)4)2 (H2 O)8
Acta Crystallographica B (24,1968-38,1982), 1982, 38, 2438-2441
2105434 CIFB4 Eu O7P n m 214.435; 10.731; 4.24
90; 90; 90
201.79Machida, K.I.; Shiokawa, J.; Adachi, G.Y.
Structure of Europium(II) Tetraborate
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2008-2011
2105435 CIFB4 Fe SmP b a m5.958; 11.53; 3.465
90; 90; 90
238.031Yvon, K.; Braun, H.F.
Sm Fe B4 - A New Ternary Boride of the Y Cr B4 Type
Acta Crystallographica B (24,1968-38,1982), 1980, 36, 2400-2402
2105436 CIFB4 Hf Ir3P 63/m7.548; 7.548; 3.487
90; 90; 120
172.047Rogl, P.
The crystal structure of Zr Ir3 B4
Acta Crystallographica B (24,1968-38,1982), 1978, 34, 721-724
2105437 CIFB4 LaP 4/m b m7.324; 7.324; 4.181
90; 90; 90
224.273Kato, K.; Kawai, S.; Oshima, C.; Kawada, I.
Lanthanum tetraboride
Acta Crystallographica B (24,1968-38,1982), 1974, 30, 2933-2934
2105438 CIFB4 La Ru4P 42/n :27.541; 7.541; 4.012
90; 90; 90
228.149Gruettner, A.; Yvon, K.
Lanthanum ruthenium boride, La Ru4 B4
Acta Crystallographica B (24,1968-38,1982), 1979, 35, 451-453
2105439 CIF
Paper
C7 H13 F3 N3 O2 PP 1 21/a 111.3416; 9.0552; 11.803
90; 109.413; 90
1143.26Pourayoubi, Mehrdad; Toghraee, Maryam; Divjakovic, Vladimir; van der Lee, Arie; Mancilla Percino, Teresa; Leyva Ramírez, Marco A.; Saneei, Anahid
Analysis of N—H···O hydrogen bonds in new C(O)—NH—P(O)-based phosphoric triamides and analogous structures deposited in the Cambridge Structural Database
Acta Crystallographica Section B, 2013, 69, 184-194
2105440 CIF
Paper
C21 H32 Cl2 N3 O2 PP 1 21/n 110.1526; 12.902; 18.5334
90; 92.724; 90
2424.93Pourayoubi, Mehrdad; Toghraee, Maryam; Divjakovic, Vladimir; van der Lee, Arie; Mancilla Percino, Teresa; Leyva Ramírez, Marco A.; Saneei, Anahid
Analysis of N—H···O hydrogen bonds in new C(O)—NH—P(O)-based phosphoric triamides and analogous structures deposited in the Cambridge Structural Database
Acta Crystallographica Section B, 2013, 69, 184-194
2105441 CIF
Paper
C23 H24 Cl2 N3 O2 PP 1 21/c 110.0375; 23.0525; 10.17
90; 96.809; 90
2336.63Pourayoubi, Mehrdad; Toghraee, Maryam; Divjakovic, Vladimir; van der Lee, Arie; Mancilla Percino, Teresa; Leyva Ramírez, Marco A.; Saneei, Anahid
Analysis of N—H···O hydrogen bonds in new C(O)—NH—P(O)-based phosphoric triamides and analogous structures deposited in the Cambridge Structural Database
Acta Crystallographica Section B, 2013, 69, 184-194
2105442 CIF
HKL
Paper
C15 H24 Cl2 N3 O2 PP -19.7455; 10.0122; 11.7163
66.278; 67.729; 84.121
966.85Pourayoubi, Mehrdad; Toghraee, Maryam; Divjakovic, Vladimir; van der Lee, Arie; Mancilla Percino, Teresa; Leyva Ramírez, Marco A.; Saneei, Anahid
Analysis of N—H···O hydrogen bonds in new C(O)—NH—P(O)-based phosphoric triamides and analogous structures deposited in the Cambridge Structural Database
Acta Crystallographica Section B, 2013, 69, 184-194
2105443 CIF
HKL
Paper
C80.75 H175.5 O82.25C 1 2 128.7452; 27.0276; 15.7252
90; 95.827; 90
12154Gallois-Montbrun, Delphine; Le Bas, Geneviève; Mason, Sax A.; Prangé, Thierry; Lesieur, Sylviane
A highly hydrated α-cyclodextrin/1-undecanol inclusion complex: crystal structure and hydrogen-bond network from high-resolution neutron diffraction at 20K
Acta Crystallographica Section B, 2013, 69, 214-227
2105444 CIF
HKL
Paper
C79.46 H120.12 O73.55C 1 2 128.725; 27.195; 15.838
90; 95.92; 90
12306Gallois-Montbrun, Delphine; Le Bas, Geneviève; Mason, Sax A.; Prangé, Thierry; Lesieur, Sylviane
A highly hydrated α-cyclodextrin/1-undecanol inclusion complex: crystal structure and hydrogen-bond network from high-resolution neutron diffraction at 20K
Acta Crystallographica Section B, 2013, 69, 214-227
2105445 CIF
HKL
Paper
C78.5 H86.4 O73.2C 1 2 128.712; 27.267; 15.79
90; 95.4; 90
12307Gallois-Montbrun, Delphine; Le Bas, Geneviève; Mason, Sax A.; Prangé, Thierry; Lesieur, Sylviane
A highly hydrated α-cyclodextrin/1-undecanol inclusion complex: crystal structure and hydrogen-bond network from high-resolution neutron diffraction at 20K
Acta Crystallographica Section B, 2013, 69, 214-227
2105446 CIF
Paper
C4 H10 OP 15.10141; 5.53079; 9.0323
79.0266; 75.7579; 78.8261
239.586Derollez, Patrick; Hédoux, Alain; Guinet, Yannick; Danède, Florence; Paccou, Laurent
Structure determination of the crystalline phase of <i>n</i>-butanol by powder X-ray diffraction and study of intermolecular associations by Raman spectroscopy
Acta Crystallographica Section B, 2013, 69, 195-202
2105447 CIF
HKL
Paper
C5 H11 N O7P 1 21/c 112.456; 6.4891; 11.338
90; 113.57; 90
840Zakharov, Boris A.; Boldyreva, Elena V.
A high-pressure single-crystal to single-crystal phase transition in <small>DL</small>-alaninium semi-oxalate monohydrate with switching-over hydrogen bonds
Acta Crystallographica Section B, 2013, 69, 271-280
2105448 CIF
HKL
Paper
C5 H11 N O7P 1 21/c 112.451; 6.4259; 11.317
90; 113.54; 90
830.1Zakharov, Boris A.; Boldyreva, Elena V.
A high-pressure single-crystal to single-crystal phase transition in <small>DL</small>-alaninium semi-oxalate monohydrate with switching-over hydrogen bonds
Acta Crystallographica Section B, 2013, 69, 271-280
2105449 CIF
HKL
Paper
C5 H11 N O7P 1 21/c 112.421; 6.2751; 11.273
90; 113.48; 90
805.9Zakharov, Boris A.; Boldyreva, Elena V.
A high-pressure single-crystal to single-crystal phase transition in <small>DL</small>-alaninium semi-oxalate monohydrate with switching-over hydrogen bonds
Acta Crystallographica Section B, 2013, 69, 271-280
2105450 CIF
HKL
Paper
C5 H11 N O7P 1 21/c 112.406; 6.1807; 11.236
90; 113.29; 90
791.3Zakharov, Boris A.; Boldyreva, Elena V.
A high-pressure single-crystal to single-crystal phase transition in <small>DL</small>-alaninium semi-oxalate monohydrate with switching-over hydrogen bonds
Acta Crystallographica Section B, 2013, 69, 271-280
2105451 CIF
HKL
Paper
C5 H11 N O7P 1 21/c 112.142; 6.1377; 11.231
90; 116.97; 90
746Zakharov, Boris A.; Boldyreva, Elena V.
A high-pressure single-crystal to single-crystal phase transition in <small>DL</small>-alaninium semi-oxalate monohydrate with switching-over hydrogen bonds
Acta Crystallographica Section B, 2013, 69, 271-280
2105452 CIF
HKL
Paper
C5 H11 N O7P 1 21/c 112.037; 6.0534; 11.211
90; 117.41; 90
725.2Zakharov, Boris A.; Boldyreva, Elena V.
A high-pressure single-crystal to single-crystal phase transition in <small>DL</small>-alaninium semi-oxalate monohydrate with switching-over hydrogen bonds
Acta Crystallographica Section B, 2013, 69, 271-280
2105453 CIF
HKL
Paper
C5 H11 N O7P 1 21/c 111.976; 6.0032; 11.199
90; 117.61; 90
713.5Zakharov, Boris A.; Boldyreva, Elena V.
A high-pressure single-crystal to single-crystal phase transition in <small>DL</small>-alaninium semi-oxalate monohydrate with switching-over hydrogen bonds
Acta Crystallographica Section B, 2013, 69, 271-280
2105454 CIF
HKL
Paper
C5 H11 N O7P 1 21/c 111.905; 5.9492; 11.185
90; 117.79; 90
700.8Zakharov, Boris A.; Boldyreva, Elena V.
A high-pressure single-crystal to single-crystal phase transition in <small>DL</small>-alaninium semi-oxalate monohydrate with switching-over hydrogen bonds
Acta Crystallographica Section B, 2013, 69, 271-280
2105455 CIF
HKL
Paper
C5 H11 N O7P 1 21/c 111.807; 5.8748; 11.164
90; 117.98; 90
683.9Zakharov, Boris A.; Boldyreva, Elena V.
A high-pressure single-crystal to single-crystal phase transition in <small>DL</small>-alaninium semi-oxalate monohydrate with switching-over hydrogen bonds
Acta Crystallographica Section B, 2013, 69, 271-280
2105456 CIF
HKL
Paper
C16 H10 Br N O3P 1 21/n 15.466; 17.381; 13.948
90; 92.079; 90
1324.3Gomes, Ligia Rebelo; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Reis, Joana; Borges, Fernanda
Structural characterization of some <i>N</i>-phenyl-4-oxo-4<i>H</i>-2-chromone carboxamides
Acta Crystallographica Section B, 2013, 69, 294-309
2105457 CIF
HKL
Paper
C16 H10 Br N O3P c a 2123.047; 4.8246; 12.075
90; 90; 90
1342.7Gomes, Ligia Rebelo; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Reis, Joana; Borges, Fernanda
Structural characterization of some <i>N</i>-phenyl-4-oxo-4<i>H</i>-2-chromone carboxamides
Acta Crystallographica Section B, 2013, 69, 294-309
2105458 CIF
HKL
Paper
C16 H10 Br N O3P -15.722; 7.968; 14.558
96.004; 99.996; 92.558
648.7Gomes, Ligia Rebelo; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Reis, Joana; Borges, Fernanda
Structural characterization of some <i>N</i>-phenyl-4-oxo-4<i>H</i>-2-chromone carboxamides
Acta Crystallographica Section B, 2013, 69, 294-309
2105459 CIF
HKL
Paper
C16 H10 N2 O5P 1 21/c 112.3425; 5.885; 18.316
90; 99.543; 90
1312Gomes, Ligia Rebelo; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Reis, Joana; Borges, Fernanda
Structural characterization of some <i>N</i>-phenyl-4-oxo-4<i>H</i>-2-chromone carboxamides
Acta Crystallographica Section B, 2013, 69, 294-309
2105460 CIF
HKL
Paper
C17 H13 N O4P 21 21 214.7199; 15.345; 19.338
90; 90; 90
1400.6Gomes, Ligia Rebelo; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Reis, Joana; Borges, Fernanda
Structural characterization of some <i>N</i>-phenyl-4-oxo-4<i>H</i>-2-chromone carboxamides
Acta Crystallographica Section B, 2013, 69, 294-309
2105461 CIF
HKL
Paper
C17 H13 N O4P n a 2112.82; 26.29; 3.802
90; 90; 90
1281Gomes, Ligia Rebelo; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Reis, Joana; Borges, Fernanda
Structural characterization of some <i>N</i>-phenyl-4-oxo-4<i>H</i>-2-chromone carboxamides
Acta Crystallographica Section B, 2013, 69, 294-309
2105462 CIF
HKL
Paper
C18 H15 N O3P b c a21.094; 16.297; 8.402
90; 90; 90
2888Gomes, Ligia Rebelo; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Reis, Joana; Borges, Fernanda
Structural characterization of some <i>N</i>-phenyl-4-oxo-4<i>H</i>-2-chromone carboxamides
Acta Crystallographica Section B, 2013, 69, 294-309
2105463 CIF
HKL
Paper
C18 H15 N O4P 1 21/c 114.327; 8.468; 12.708
90; 110.514; 90
1444Gomes, Ligia Rebelo; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Reis, Joana; Borges, Fernanda
Structural characterization of some <i>N</i>-phenyl-4-oxo-4<i>H</i>-2-chromone carboxamides
Acta Crystallographica Section B, 2013, 69, 294-309
2105464 CIF
HKL
Paper
C17 H13 N O3P -17.4724; 9.3647; 10.5398
88.283; 71.173; 72.42
663.61Gomes, Ligia Rebelo; Low, John Nicolson; Cagide, Fernando; Gaspar, Alexandra; Reis, Joana; Borges, Fernanda
Structural characterization of some <i>N</i>-phenyl-4-oxo-4<i>H</i>-2-chromone carboxamides
Acta Crystallographica Section B, 2013, 69, 294-309
2105465 CIF
Paper
C5 H12 N2P 1 21 15.213; 8.471; 7.2048
90; 105.362; 90
306.79Reibenspies, Joseph; Bhuvanesh, Nattamai
Absolute structure of <i>R</i>-({-})-2-methylpiperazine and <i>S</i>-(+)-2-methylpiperazine
Acta Crystallographica Section B, 2013, 69, 288-293
2105466 CIF
HKL
Paper
C5 H12 N2P 1 21 15.209; 8.4798; 7.2037
90; 105.254; 90
306.99Reibenspies, Joseph; Bhuvanesh, Nattamai
Absolute structure of <i>R</i>-({-})-2-methylpiperazine and <i>S</i>-(+)-2-methylpiperazine
Acta Crystallographica Section B, 2013, 69, 288-293
2105467 CIF
HKL
Paper
C5 H14.71 Br2 N2 O0.36P 1 21 16.0418; 11.5649; 7.1333
90; 106.911; 90
476.87Reibenspies, Joseph; Bhuvanesh, Nattamai
Absolute structure of <i>R</i>-({-})-2-methylpiperazine and <i>S</i>-(+)-2-methylpiperazine
Acta Crystallographica Section B, 2013, 69, 288-293
2105468 CIF
HKL
Paper
C5 H14.5 Br2 N2 O0.25P 1 21 16.0262; 11.555; 7.1392
90; 107.018; 90
475.35Reibenspies, Joseph; Bhuvanesh, Nattamai
Absolute structure of <i>R</i>-({-})-2-methylpiperazine and <i>S</i>-(+)-2-methylpiperazine
Acta Crystallographica Section B, 2013, 69, 288-293
2105469 CIF
Paper
Al220.86 Cu13.7 Ta150P 63/m m c13.512; 13.512; 39.022
90; 90; 120
6169.9Dshemuchadse, Julia; Bigler, Sandro; Simonov, Arkadiy; Weber, Thomas; Steurer, Walter
A new complex intermetallic phase in the system Al‒Cu‒Ta with familiar clusters and packing principles
Acta Crystallographica Section B, 2013, 69, 238-248
2105470 CIF
Paper
C15 H24 F2 N3 O2 PP -19.8932; 10.5022; 19.228
79.853; 81.589; 62.86
1745.1Tarahhomi, Atekeh; Pourayoubi, Mehrdad; Golen, James A.; Zargaran, Poorya; Elahi, Behrouz; Rheingold, Arnold L.; Leyva Ramírez, Marco A.; Mancilla Percino, Teresa
Hirshfeld surface analysis of new phosphoramidates
Acta Crystallographica Section B, 2013, 69, 260-270
2105471 CIF
Paper
C13 H20 F2 N3 O3 PP 21 21 218.7127; 10.9675; 16.8649
90; 90; 90
1611.55Tarahhomi, Atekeh; Pourayoubi, Mehrdad; Golen, James A.; Zargaran, Poorya; Elahi, Behrouz; Rheingold, Arnold L.; Leyva Ramírez, Marco A.; Mancilla Percino, Teresa
Hirshfeld surface analysis of new phosphoramidates
Acta Crystallographica Section B, 2013, 69, 260-270
2105472 CIF
Paper
C16 H18 N O4 PP 1 21 16.4231; 9.1119; 13.6799
90; 94.137; 90
798.55Tarahhomi, Atekeh; Pourayoubi, Mehrdad; Golen, James A.; Zargaran, Poorya; Elahi, Behrouz; Rheingold, Arnold L.; Leyva Ramírez, Marco A.; Mancilla Percino, Teresa
Hirshfeld surface analysis of new phosphoramidates
Acta Crystallographica Section B, 2013, 69, 260-270
2105473 CIF
Paper
C18 H15 Br N O3 PP -110.1842; 10.2741; 10.7121
108.304; 94.3109; 118.084
904.95Tarahhomi, Atekeh; Pourayoubi, Mehrdad; Golen, James A.; Zargaran, Poorya; Elahi, Behrouz; Rheingold, Arnold L.; Leyva Ramírez, Marco A.; Mancilla Percino, Teresa
Hirshfeld surface analysis of new phosphoramidates
Acta Crystallographica Section B, 2013, 69, 260-270
2105474 CIF
Paper
C32 H40 N4 O3 P2C 1 2/c 119.05; 8.5308; 18.821
90; 97.341; 90
3033.6Tarahhomi, Atekeh; Pourayoubi, Mehrdad; Golen, James A.; Zargaran, Poorya; Elahi, Behrouz; Rheingold, Arnold L.; Leyva Ramírez, Marco A.; Mancilla Percino, Teresa
Hirshfeld surface analysis of new phosphoramidates
Acta Crystallographica Section B, 2013, 69, 260-270
2105475 CIF
Paper
C28 H32 N4 O3 P2P c c n13.4363; 20.3532; 9.8851
90; 90; 90
2703.3Tarahhomi, Atekeh; Pourayoubi, Mehrdad; Golen, James A.; Zargaran, Poorya; Elahi, Behrouz; Rheingold, Arnold L.; Leyva Ramírez, Marco A.; Mancilla Percino, Teresa
Hirshfeld surface analysis of new phosphoramidates
Acta Crystallographica Section B, 2013, 69, 260-270
2105476 CIF
Paper
I3 Nb10 Se40P 4/m c c9.4644; 9.4644; 31.9063
90; 90; 90
2858Zubko, Maciej; Kusz, Joachim; Prodan, Albert; Šturm, Sašo; van Midden, Herman J. P.; Bennett, J. Craig; Dubin, Grzegorz; Zupanič, Erik; Böhm, Horst
Structural phase transition and related electronic properties in quasi-one-dimensional (NbSe~4~)~10/3~I
Acta Crystallographica Section B, 2013, 69, 229-237
2105477 CIF
Paper
I3 Nb10 Se40P 1 2/c 19.4415; 9.4235; 31.883
90; 92.352; 90
2834.3Zubko, Maciej; Kusz, Joachim; Prodan, Albert; Šturm, Sašo; van Midden, Herman J. P.; Bennett, J. Craig; Dubin, Grzegorz; Zupanič, Erik; Böhm, Horst
Structural phase transition and related electronic properties in quasi-one-dimensional (NbSe~4~)~10/3~I
Acta Crystallographica Section B, 2013, 69, 229-237
2105478 CIFGa SeP -6 m 23.743; 3.743; 15.919
90; 90; 120
193.146Cenzual, K.; Gelato, L.M.; Penzo, M.; Parthe, E.
Inorganic structure types with revised space groups.I.
Acta Crystallographica B, 1991, 47, 433-439
2105479 CIF
HKL
Paper
C2 H6 N2 SP -17.6615; 7.6945; 8.0283
78.182; 73.785; 81.448
442.71Jones, Peter G.; Taouss, Christina; Teschmit, Nicole; Thomas, Lena
Methylthioureas and their morpholine and dioxane adducts; hydrogen-bonding patterns
Acta Crystallographica Section B, 2013, 69, 405-413
2105480 CIF
HKL
Paper
C3 H8 N2 SP b c a6.15884; 11.5953; 14.639
90; 90; 90
1045.42Jones, Peter G.; Taouss, Christina; Teschmit, Nicole; Thomas, Lena
Methylthioureas and their morpholine and dioxane adducts; hydrogen-bonding patterns
Acta Crystallographica Section B, 2013, 69, 405-413
2105481 CIF
HKL
Paper
C6 H15 N3 O SP 1 21/n 16.56953; 8.7346; 16.2322
90; 96.964; 90
924.57Jones, Peter G.; Taouss, Christina; Teschmit, Nicole; Thomas, Lena
Methylthioureas and their morpholine and dioxane adducts; hydrogen-bonding patterns
Acta Crystallographica Section B, 2013, 69, 405-413
2105482 CIF
HKL
Paper
C5 H12 N2 O SP 1 21/c 16.4979; 7.0116; 16.7097
90; 92.982; 90
760.27Jones, Peter G.; Taouss, Christina; Teschmit, Nicole; Thomas, Lena
Methylthioureas and their morpholine and dioxane adducts; hydrogen-bonding patterns
Acta Crystallographica Section B, 2013, 69, 405-413
2105483 CIF
HKL
Paper
C5 H12 N2 O SP -16.847; 7.0982; 8.6412
106.676; 105.448; 90.679
386Jones, Peter G.; Taouss, Christina; Teschmit, Nicole; Thomas, Lena
Methylthioureas and their morpholine and dioxane adducts; hydrogen-bonding patterns
Acta Crystallographica Section B, 2013, 69, 405-413
2105484 CIF
HKL
Paper
C5 H12 N2 SC 1 2/c 15.4621; 12.0353; 10.9309
90; 95.641; 90
715.1Jones, Peter G.; Taouss, Christina; Teschmit, Nicole; Thomas, Lena
Methylthioureas and their morpholine and dioxane adducts; hydrogen-bonding patterns
Acta Crystallographica Section B, 2013, 69, 405-413
2105485 CIF
Paper
H13 N3 O8 S2P -18.282; 10.095; 11.613
90.44; 110.07; 100.64
893.6Sohn, Yoo Jung; Sparta, Karine M.; Prinz, Sebastian; Meven, Martin; Roth, Georg; Heger, Gernot
Proton ordering in (NH~4~)~3~H(SO~4~)~2~ at low-temperature phase transitions
Acta Crystallographica Section B, 2013, 69, 336-343
2105486 CIF
HKL
Paper
H13 N3 O8 S2P 1 2/n 115.473; 5.849; 10.131
90; 101.75; 90
897.7Sohn, Yoo Jung; Sparta, Karine M.; Prinz, Sebastian; Meven, Martin; Roth, Georg; Heger, Gernot
Proton ordering in (NH~4~)~3~H(SO~4~)~2~ at low-temperature phase transitions
Acta Crystallographica Section B, 2013, 69, 336-343
2105487 CIF
HKL
Paper
H13 N3 O8 S2P 1 2/n 115.534; 5.825; 10.089
90; 101.52; 90
894.5Sohn, Yoo Jung; Sparta, Karine M.; Prinz, Sebastian; Meven, Martin; Roth, Georg; Heger, Gernot
Proton ordering in (NH~4~)~3~H(SO~4~)~2~ at low-temperature phase transitions
Acta Crystallographica Section B, 2013, 69, 336-343
2105488 CIF
Paper
H13 N3 O8 S2P 1 2/n 115.538; 11.641; 10.085
90; 101.46; 90
1787.8Sohn, Yoo Jung; Sparta, Karine M.; Prinz, Sebastian; Meven, Martin; Roth, Georg; Heger, Gernot
Proton ordering in (NH~4~)~3~H(SO~4~)~2~ at low-temperature phase transitions
Acta Crystallographica Section B, 2013, 69, 336-343
2105489 CIF
Paper
H12 Li4 O12 P2I a -312.7; 12.7; 12.7
90; 90; 90
2048.4Kinzhybalo, Vasyl; Mermer, Adrian; Lis, Tadeusz; Starynowicz, Przemysław
Electron density distribution in tetralithium hypodiphosphate hexahydrate, Li~4~P~2~O~6~·6H~2~O
Acta Crystallographica Section B, 2013, 69, 344-355
2105490 CIF
HKL
Paper
C22 H24 Cl N5 O2P 1 21/c 120.214; 6.8155; 15.863
90; 109.604; 90
2058.7Bruni, Giovanna; Maietta, Mariarosa; Scotti, Federico; Maggi, Lauretta; Bini, Marcella; Ferrari, Stefania; Capsoni, Doretta; Boiocchi, Massimo; Berbenni, Vittorio; Milanese, Chiara; Girella, Alessandro; Marini, Amedeo
Structure and properties of domperidone and its succinate salt
Acta Crystallographica Section B, 2013, 69, 362-370
2105491 CIF
HKL
Paper
C26 H30 Cl N5 O6P -16.3869; 8.9838; 23.094
89.89; 82.52; 86.52
1311.4Bruni, Giovanna; Maietta, Mariarosa; Scotti, Federico; Maggi, Lauretta; Bini, Marcella; Ferrari, Stefania; Capsoni, Doretta; Boiocchi, Massimo; Berbenni, Vittorio; Milanese, Chiara; Girella, Alessandro; Marini, Amedeo
Structure and properties of domperidone and its succinate salt
Acta Crystallographica Section B, 2013, 69, 362-370
2105492 CIF
Paper
C8 H14 N2 O2P 1 21/c 19.5932; 7.8325; 11.9547
90; 103.83; 90
872.22Herman, Christelle; Vermylen, Valérie; Norberg, Bernadette; Wouters, Johan; Leyssens, Tom
The importance of screening solid-state phases of a racemic modification of a chiral drug: thermodynamic and structural characterization of solid-state phases of etiracetam
Acta Crystallographica Section B, 2013, 69, 371-378
2105493 CIF
Paper
C8 H14 N2 O2P 1 21/c 19.302; 11.5223; 8.4172
90; 95.966; 90
897.27Herman, Christelle; Vermylen, Valérie; Norberg, Bernadette; Wouters, Johan; Leyssens, Tom
The importance of screening solid-state phases of a racemic modification of a chiral drug: thermodynamic and structural characterization of solid-state phases of etiracetam
Acta Crystallographica Section B, 2013, 69, 371-378
2105494 CIF
Paper
C8 H16 N2 O3P -17.2006; 7.9639; 9.5468
85.293; 76.031; 70.023
499.3Herman, Christelle; Vermylen, Valérie; Norberg, Bernadette; Wouters, Johan; Leyssens, Tom
The importance of screening solid-state phases of a racemic modification of a chiral drug: thermodynamic and structural characterization of solid-state phases of etiracetam
Acta Crystallographica Section B, 2013, 69, 371-378
2105495 CIFC19 H24 Cl2 N2P 1 21/c 115.506; 8.605; 14.031
90; 96.69; 90
1859.4Post, M. L.; Horn, A. S.
The crystal and molecular structure of the tricyclic antidepressant chlorimipramine hydrochloride: 3-chloro-5-(3-dimethylaminopropyl)-10,11-dihydro-5H-dibenz[b,f]azepine hydrochloride
Acta Crystallographica, Section B, 1977, 33, 2590-2595
2105496 CIF
Paper
C6 H8 Fe O8P 21 21 215.947; 10.4021; 13.5773
90; 90; 90
839.91Birsa Čelič, Tadeja; Jagličič, Zvonko; Lazar, Karoly; Zabukovec Logar, Nataša
Structure and magnetic properties of a new iron(II) citrate coordination polymer
Acta Crystallographica Section B, 2013, 69, 490-495
2105497 CIF
Paper
C16 H32 Cr N8 O12 Rh4I 41/a :29.4384; 9.4384; 29.75
90; 90; 90
2650.2Ebihara, Masahiro; Fuma, Yasuhiro
Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions
Acta Crystallographica Section B, 2013, 69, 480-489
2105498 CIF
Paper
C16 H32 Mo N8 O12 Rh4I 41/a :29.5725; 9.5725; 29.627
90; 90; 90
2714.8Ebihara, Masahiro; Fuma, Yasuhiro
Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions
Acta Crystallographica Section B, 2013, 69, 480-489
2105499 CIF
Paper
C16 H32 N8 O12 Rh4 WI 41/a :29.5905; 9.5905; 29.625
90; 90; 90
2724.8Ebihara, Masahiro; Fuma, Yasuhiro
Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions
Acta Crystallographica Section B, 2013, 69, 480-489
2105500 CIF
Paper
C16 H32 Cr N8 O12 Ru4I 41/a :29.4232; 9.4232; 30.168
90; 90; 90
2678.8Ebihara, Masahiro; Fuma, Yasuhiro
Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions
Acta Crystallographica Section B, 2013, 69, 480-489
2105501 CIF
Paper
C16 H32 Mo N8 O12 Ru4I 41/a :29.5504; 9.5504; 29.933
90; 90; 90
2730.2Ebihara, Masahiro; Fuma, Yasuhiro
Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions
Acta Crystallographica Section B, 2013, 69, 480-489
2105502 CIF
Paper
C16 H32 N8 O12 Ru4 WI 41/a :29.5668; 9.5668; 29.98
90; 90; 90
2743.9Ebihara, Masahiro; Fuma, Yasuhiro
Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions
Acta Crystallographica Section B, 2013, 69, 480-489
2105503 CIF
Paper
C24 H50.16 Cr N8 O13.08 Rh4P -112.978; 13.576; 14.498
112.405; 101.362; 106.816
2119.9Ebihara, Masahiro; Fuma, Yasuhiro
Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions
Acta Crystallographica Section B, 2013, 69, 480-489
2105504 CIF
Paper
C24 H52.88 Mo N8 O14.44 Rh4P -112.952; 13.849; 14.679
112.46; 99.574; 108.472
2180.4Ebihara, Masahiro; Fuma, Yasuhiro
Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions
Acta Crystallographica Section B, 2013, 69, 480-489
2105505 CIF
Paper
C32 H64 Mo N8 O12 Rh4P -115.567; 15.778; 19.221
87.72; 89.872; 78.448
4622Ebihara, Masahiro; Fuma, Yasuhiro
Two- and three-dimensional assembled structures constructed from amidate-bridged paddlewheel complexes with group 6 oxometallate ions
Acta Crystallographica Section B, 2013, 69, 480-489
2105506 CIF
Paper
C10 H14 O5X c37.8883; 4.7233; 11.6835
90; 90; 90
2090.9Jahangiri, Amita; Fleckhaus, Andre; Lidin, Sven; Strand, Daniel
Allotwinning in a molecular crystal: (1<i>R</i>,3<i>S</i>)-dimethyl 2-oxocyclohexane-1,3-dicarboxylate
Acta Crystallographica Section B, 2013, 69, 509-513
2105507 CIF
Paper
H2 Na O4 PP 1 21/c 16.8093; 13.3936; 7.2786
90; 92.827; 90
663.01Ichikawa, M.; Gustafsson, T.; Olovsson, I.
Experimental Electron Density Study of NaH~2~PO~4~ at 30 K
Acta Crystallographica Section B, 1998, 54, 29-34
2105508 CIF
Paper
C16 H15 N2 O3 PP -16.9026; 9.7086; 12.201
77.138; 74.345; 75.477
751.55Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.
Chain, Sheet and Framework Structures in the Adducts of Phenylphosphonic Acid with 4,4'-Bipyridyl (1/1), Piperazine (2/1) and 1,4-Diazabicyclo[2.2.2]octane (2/1)
Acta Crystallographica Section B, 1998, 54, 129-138
2105509 CIF
Paper
C16 H24 N2 O6 P2P 1 21/n 16.0042; 19.746; 8.651
90; 105.63; 90
987.7Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.
Chain, Sheet and Framework Structures in the Adducts of Phenylphosphonic Acid with 4,4'-Bipyridyl (1/1), Piperazine (2/1) and 1,4-Diazabicyclo[2.2.2]octane (2/1)
Acta Crystallographica Section B, 1998, 54, 129-138
2105510 CIF
Paper
C18 H26 N2 O6 P2P 1 21/n 16.3607; 21.83; 14.5965
90; 92.558; 90
2024.76Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.
Chain, Sheet and Framework Structures in the Adducts of Phenylphosphonic Acid with 4,4'-Bipyridyl (1/1), Piperazine (2/1) and 1,4-Diazabicyclo[2.2.2]octane (2/1)
Acta Crystallographica Section B, 1998, 54, 129-138
2105511 CIF
Paper
C34 H44 N4 O4 S2P 1 21/c 111.1602; 10.8084; 14.001
90; 103.127; 90
1644.7Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.
Crystal Engineering Using Bis- and Tris-phenols. Adducts with 1,4,8,11-Tetraazacyclotetradecane (Cyclam): Isolated Ladders in the Adduct with 4,4'-Thiodiphenol, Tethered Ladders in the Adduct with 4,4'-Sulfonyldiphenol and Two Interwoven Three-Dimensional Networks in the Adduct with 1,1,1-Tris(4-hydroxyphenyl)ethane
Acta Crystallographica Section B, 1998, 54, 139-150
2105512 CIF
Paper
C34 H44 N4 O8 S2P -110.9345; 11.006; 14.35
79.532; 86.739; 87.471
1694.5Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.
Crystal Engineering Using Bis- and Tris-phenols. Adducts with 1,4,8,11-Tetraazacyclotetradecane (Cyclam): Isolated Ladders in the Adduct with 4,4'-Thiodiphenol, Tethered Ladders in the Adduct with 4,4'-Sulfonyldiphenol and Two Interwoven Three-Dimensional Networks in the Adduct with 1,1,1-Tris(4-hydroxyphenyl)ethane
Acta Crystallographica Section B, 1998, 54, 139-150
2105513 CIF
Paper
C51 H64 N4 O7P -18.2208; 16.245; 17.337
81.694; 89.656; 86.468
2286.7Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.
Crystal Engineering Using Bis- and Tris-phenols. Adducts with 1,4,8,11-Tetraazacyclotetradecane (Cyclam): Isolated Ladders in the Adduct with 4,4'-Thiodiphenol, Tethered Ladders in the Adduct with 4,4'-Sulfonyldiphenol and Two Interwoven Three-Dimensional Networks in the Adduct with 1,1,1-Tris(4-hydroxyphenyl)ethane
Acta Crystallographica Section B, 1998, 54, 139-150
2105514 CIF
Paper
C18 H22 N2 O2C 1 2/c 112.151; 6.3202; 21.051
90; 98.875; 90
1597.3Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.; Patterson, I. L. J.
Formation of One-Dimensional Chains, Two-Dimensional Bilayers and a Three-Dimensional Diamondoid Architecture in Hydrogen-Bonded Adducts of 4,4'-Biphenol with 1,4-Diazabicyclo[2.2.2]octane and 1,2-Diaminoethane
Acta Crystallographica Section B, 1998, 54, 151-161
2105515 CIF
Paper
C27 H32 N2 O5P -19.4592; 10.6311; 12.2085
91.812; 93.091; 90.652
1225.2Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.; Patterson, I. L. J.
Formation of One-Dimensional Chains, Two-Dimensional Bilayers and a Three-Dimensional Diamondoid Architecture in Hydrogen-Bonded Adducts of 4,4'-Biphenol with 1,4-Diazabicyclo[2.2.2]octane and 1,2-Diaminoethane
Acta Crystallographica Section B, 1998, 54, 151-161
2105516 CIF
Paper
C14 H18 N2 O2P 1 21/a 18.2121; 5.3401; 14.6014
90; 99.962; 90
630.67Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.; Patterson, I. L. J.
Formation of One-Dimensional Chains, Two-Dimensional Bilayers and a Three-Dimensional Diamondoid Architecture in Hydrogen-Bonded Adducts of 4,4'-Biphenol with 1,4-Diazabicyclo[2.2.2]octane and 1,2-Diaminoethane
Acta Crystallographica Section B, 1998, 54, 151-161
2105517 CIF
Paper
Cl6 K2 PtF m -3 m9.6781; 9.6781; 9.6781
90; 90; 90
906.51Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105518 CIF
Paper
Cl6 K2 PtF m -3 m9.6555; 9.6555; 9.6555
90; 90; 90
900.17Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105519 CIF
Paper
Cl6 K2 PtF m -3 m9.7525; 9.7525; 9.7525
90; 90; 90
927.6Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105520 CIF
Paper
Cl6 K2 PtF m -3 m9.7799; 9.7799; 9.7799
90; 90; 90
935.41Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105521 CIF
Paper
Cl6 K2 PtF m -3 m9.6489; 9.6489; 9.6489
90; 90; 90
898.32Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105522 CIF
Paper
Cl6 K2 PtF m -3 m9.6654; 9.6654; 9.6654
90; 90; 90
902.94Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105523 CIF
Paper
Cl6 K2 PtF m -3 m9.7537; 9.7537; 9.7537
90; 90; 90
927.91Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105524 CIF
Paper
Cl6 K2 PtF m -3 m9.743; 9.743; 9.743
90; 90; 90
924.9Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105525 CIF
Paper
Cl6 K2 PtF m -3 m9.673; 9.673; 9.673
90; 90; 90
905.1Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105526 CIF
Paper
Cl6 K2 PtF m -3 m9.6911; 9.6911; 9.6911
90; 90; 90
910.16Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105527 CIF
Paper
Cl6 K2 PtF m -3 m9.6862; 9.6862; 9.6862
90; 90; 90
908.78Schefer, J.; Schwarzenbach, D.; Fischer, P.; Koetzle, Th.; Larsen, F. K.; Haussühl, S.; Rüdlinger, M.; McIntyre, G.; Birkedal, H.; Bürgi, H.-B.
Neutron and X-ray Diffraction Study of the Thermal Motion in K~2~PtCl~6~ as a Function of Temperature
Acta Crystallographica Section B, 1998, 54, 121-128
2105528 CIF
Paper
C24 H39 N O3P 6114.564; 14.564; 20.282
90; 90; 120
3725.7Maurin, J. K.
Oxime‒Carboxyl Hydrogen Bonds: the Preferred Interaction Determining Crystal Packing of `Carboxyoximes'
Acta Crystallographica Section B, 1998, 54, 866-871
2105529 CIF
Paper
C42 H44 N2 O6P -110.943; 11.1075; 15.249
98.672; 96.312; 98.377
1796.2Ferguson, G.; Glidewell, C.; Gregson, R. M.; Meehan, P. R.
Crystal Engineering Using Tris-phenols. Cross-Linked, Pairwise-Interwoven Two-Dimensional Nets in the 2:1 Adduct of 1,1,1-Tris(4-hydroxyphenyl)ethane with 1,2-Diaminoethane
Acta Crystallographica Section B, 1998, 54, 330-338
2105530 CIF
Paper
C58 H64 N2 O12P 1 21/a 113.667; 18.647; 20.188
90; 90.72; 90
5144Thuéry, Pierre; Nierlich, Martine; Calemczuk, Roberto; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques
Three conformational polymorphs and order‒disorder phase transition in a calix[4]arene bis(crown)
Acta Crystallographica Section B, 1999, 55, 95-103
2105531 CIF
Paper
C58 H64 N2 O12P 1 21/a 120.341; 11.709; 23.875
90; 112.39; 90
5258Thuéry, Pierre; Nierlich, Martine; Calemczuk, Roberto; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques
Three conformational polymorphs and order‒disorder phase transition in a calix[4]arene bis(crown)
Acta Crystallographica Section B, 1999, 55, 95-103
2105532 CIF
Paper
C58 H64 N2 O12P -120.285; 11.608; 23.894
92.22; 112.32; 87.81
5199Thuéry, Pierre; Nierlich, Martine; Calemczuk, Roberto; Saadioui, Mohamed; Asfari, Zouhair; Vicens, Jacques
Three conformational polymorphs and order‒disorder phase transition in a calix[4]arene bis(crown)
Acta Crystallographica Section B, 1999, 55, 95-103
2105533 CIF
Paper
C6 H2 F4 O2P 1 21/n 16.5533; 4.8848; 10.148
90; 107.99; 90
308.97Thalladi, Venkat R.; Weiss, Hans-Christoph; Boese, Roland; Nangia, Ashwini; Desiraju, Gautam R.
A comparative study of the crystal structures of tetrahalogenated hydroquinones and γ-hydroquinone
Acta Crystallographica Section B, 1999, 55, 1005-1013
2105534 CIF
Paper
C6 H2 Br4 O2P 1 21/n 18.8907; 4.7316; 11.0612
90; 92.167; 90
464.981Thalladi, Venkat R.; Weiss, Hans-Christoph; Boese, Roland; Nangia, Ashwini; Desiraju, Gautam R.
A comparative study of the crystal structures of tetrahalogenated hydroquinones and γ-hydroquinone
Acta Crystallographica Section B, 1999, 55, 1005-1013
2105535 CIF
Paper
C20 H18 O6 SP 1 21/n 18.489; 13.433; 15.802
90; 97.431; 90
1786.8Gallucci, J. C.; Hart, D. J.; Young, D. G. J.
Nucleophile‒Electrophile Interactions in 1,8-Disubstituted Naphthalenes: Structures of Three 1-Naphthaldehydes and a 1-Naphthyl Methyl Ketone
Acta Crystallographica Section B, 1998, 54, 73-81
2105536 CIF
Paper
C19 H16 O5 SP 1 21/n 17.922; 14.664; 14.473
90; 94.26; 90
1676.7Gallucci, J. C.; Hart, D. J.; Young, D. G. J.
Nucleophile‒Electrophile Interactions in 1,8-Disubstituted Naphthalenes: Structures of Three 1-Naphthaldehydes and a 1-Naphthyl Methyl Ketone
Acta Crystallographica Section B, 1998, 54, 73-81
2105537 CIF
Paper
C19 H14 O4P 1 21/n 18.075; 15.441; 12.239
90; 102.43; 90
1490.3Gallucci, J. C.; Hart, D. J.; Young, D. G. J.
Nucleophile‒Electrophile Interactions in 1,8-Disubstituted Naphthalenes: Structures of Three 1-Naphthaldehydes and a 1-Naphthyl Methyl Ketone
Acta Crystallographica Section B, 1998, 54, 73-81
2105538 CIF
Paper
C21 H20 O6 SP 1 21/n 110.586; 7.727; 24.361
90; 99.29; 90
1966.5Gallucci, J. C.; Hart, D. J.; Young, D. G. J.
Nucleophile‒Electrophile Interactions in 1,8-Disubstituted Naphthalenes: Structures of Three 1-Naphthaldehydes and a 1-Naphthyl Methyl Ketone
Acta Crystallographica Section B, 1998, 54, 73-81
2105539 CIF
Paper
C14 H10 N2 O2P 21 21 2119.655; 10.677; 5.503
90; 90; 90
1154.8Botoshansky, M.; Ellern, A.; Gasper, N.; Henck, J.-O.; Herbstein, F. H.
Structural, Thermodynamic and Kinetic (Hysteresis) Aspects of the Enantiotropic First-Order Phase Transformations of <i>N</i>-Anilinophthalimide and <i>N</i>-(<i>N</i>'-Methylanilino)phthalimide
Acta Crystallographica Section B, 1998, 54, 277-290
2105540 CIF
Paper
C14 H10 N2 O2P 1 21/a 114.724; 12.664; 13.97
90; 115.38; 90
2353.5Botoshansky, M.; Ellern, A.; Gasper, N.; Henck, J.-O.; Herbstein, F. H.
Structural, Thermodynamic and Kinetic (Hysteresis) Aspects of the Enantiotropic First-Order Phase Transformations of <i>N</i>-Anilinophthalimide and <i>N</i>-(<i>N</i>'-Methylanilino)phthalimide
Acta Crystallographica Section B, 1998, 54, 277-290
2105541 CIF
Paper
C15 H12 N2 O2P 1 21/c 17.752; 14.567; 11.118
90; 92.25; 90
1254.5Botoshansky, M.; Ellern, A.; Gasper, N.; Henck, J.-O.; Herbstein, F. H.
Structural, Thermodynamic and Kinetic (Hysteresis) Aspects of the Enantiotropic First-Order Phase Transformations of <i>N</i>-Anilinophthalimide and <i>N</i>-(<i>N</i>'-Methylanilino)phthalimide
Acta Crystallographica Section B, 1998, 54, 277-290
2105542 CIF
Paper
C15 H12 N2 O2P -15.745; 8.347; 14.213
74.45; 87.75; 75.39
635.1Botoshansky, M.; Ellern, A.; Gasper, N.; Henck, J.-O.; Herbstein, F. H.
Structural, Thermodynamic and Kinetic (Hysteresis) Aspects of the Enantiotropic First-Order Phase Transformations of <i>N</i>-Anilinophthalimide and <i>N</i>-(<i>N</i>'-Methylanilino)phthalimide
Acta Crystallographica Section B, 1998, 54, 277-290
2105543 CIF
Paper
C5 H8 N4 O5P 1 21/c 17.237; 6.363; 17.449
90; 90.51; 90
803.5Parkin, S.; Hope, H.
Uric Acid Dihydrate Revisited
Acta Crystallographica Section B, 1998, 54, 339-344
2105544 CIF
Paper
C31 H41 N O3P 1 21 114.453; 6.054; 16.1117
90; 105.332; 90
1359.58Hager, O.; Foces-Foces, C.; Llamas-Saiz, A. L.; Weber, E.
Temperature-Dependent Phase Transitions in Two Crystalline Host‒Guest Complexes Derived from Mandelic Acid
Acta Crystallographica Section B, 1998, 54, 82-93
2105545 CIF
Paper
C31 H41 N O3P 1 21 124.811; 6.0739; 18.8645
90; 98.1; 90
2814.5Hager, O.; Foces-Foces, C.; Llamas-Saiz, A. L.; Weber, E.
Temperature-Dependent Phase Transitions in Two Crystalline Host‒Guest Complexes Derived from Mandelic Acid
Acta Crystallographica Section B, 1998, 54, 82-93
2105546 CIF
Paper
C32 H43 N O3P 1 21 124.446; 5.9519; 20.461
90; 101.954; 90
2912.5Hager, O.; Foces-Foces, C.; Llamas-Saiz, A. L.; Weber, E.
Temperature-Dependent Phase Transitions in Two Crystalline Host‒Guest Complexes Derived from Mandelic Acid
Acta Crystallographica Section B, 1998, 54, 82-93
2105547 CIF
Paper
C32 H43 N O3P 114.417; 6.0303; 17.564
88.736; 101.43; 93.135
1494.4Hager, O.; Foces-Foces, C.; Llamas-Saiz, A. L.; Weber, E.
Temperature-Dependent Phase Transitions in Two Crystalline Host‒Guest Complexes Derived from Mandelic Acid
Acta Crystallographica Section B, 1998, 54, 82-93
2105548 CIF
Paper
Hf O3 PbP b a m5.856; 11.729; 8.212
90; 90; 90
564Corker, D. L.; Glazer, A. M.; Kaminsky, W.; Whatmore, R. W.; Dec, J.; Roleder, K.
Investigation into the Crystal Structure of the Perovskite Lead Hafnate, PbHfO~3~
Acta Crystallographica Section B, 1998, 54, 18-28
2105549 CIF
Paper
Hf O3 PbP b a m5.8582; 11.7224; 8.2246
90; 90; 90
564.8Corker, D. L.; Glazer, A. M.; Kaminsky, W.; Whatmore, R. W.; Dec, J.; Roleder, K.
Investigation into the Crystal Structure of the Perovskite Lead Hafnate, PbHfO~3~
Acta Crystallographica Section B, 1998, 54, 18-28
2105550 CIF
Paper
C5 H16 Cl4 Co N2P 1 21/c 17.1633; 15.94; 11.137
90; 98.44; 90
1257.9Criado, J. J.; Jiménez-Sánchez, A.; Cano, F. H.; Sáez-Puche, R.; Rodríguez-Fernández, E.
Preparation and characterization of tetrachlorocobaltates(II) of α,ω-alkylenediammonium. Magnetic and thermal properties. Crystal structure of [NH~3~(CH~2~)~5~NH~3~]CoCl~4~
Acta Crystallographica Section B, 1999, 55, 947-952
2105551 CIF
Paper
Al0.97 Ge1.03 K0.19 Na0.78 O4P 6310.164; 10.164; 8.54
90; 90; 120
764Hammond, R. P.; Barbier, J.
Monoclinic and Hexagonal Nepheline Structures of (Na~3/4~/K~1/4~)AlGeO~4~
Acta Crystallographica Section B, 1998, 54, 211-220
2105552 CIF
Paper
Al Ge K0.25 Na0.75 O4P 1 21 110.0477; 8.5764; 10.2118
90; 119.035; 90
769.39Hammond, R. P.; Barbier, J.
Monoclinic and Hexagonal Nepheline Structures of (Na~3/4~/K~1/4~)AlGeO~4~
Acta Crystallographica Section B, 1998, 54, 211-220
2105553 CIF
Paper
C4 H16 N4 Ni O14 V6P 1 21/c 18.9311; 17.127; 6.627
90; 111.61; 90
942.4Zavalij, Peter Y.; Zhang, Fan; Whittingham, M. Stanley
Crystal structure of layered bis(ethylenediamine)nickel hexavanadate as a new representative of the V~6~O~14~ series
Acta Crystallographica Section B, 1999, 55, 953-962
2105554 CIF
Paper
C4 H16 N4 Ni O14 V6P 1 21/n 117.862; 17.127; 6.627
90; 111.61; 90
1884.9Zavalij, Peter Y.; Zhang, Fan; Whittingham, M. Stanley
Crystal structure of layered bis(ethylenediamine)nickel hexavanadate as a new representative of the V~6~O~14~ series
Acta Crystallographica Section B, 1999, 55, 953-962
2105555 CIF
Paper
La Mo2 O5P 63/m m c8.368; 8.368; 19.13687
90; 90; 120
1160.5Hibble, Simon J.; Cooper, Steven P.; Patat, Saban; Hannon, Alex C.
Total neutron diffraction: a route to the correct local structure of disordered LaMo~2~O~5~ and its application to the model compound Zn~2~Mo~3~O~8~
Acta Crystallographica Section B, 1999, 55, 683-697
2105556 CIF
Paper
Mo3 O8 Zn2P 63 m c5.77322; 5.77322; 9.91231
90; 90; 120
286.116Hibble, Simon J.; Cooper, Steven P.; Patat, Saban; Hannon, Alex. C.
Total neutron diffraction: a route to the correct local structure of disordered LaMo~2~O~5~ and its application to the model compound Zn~2~Mo~3~O~8~
Acta Crystallographica Section B, 1999, 55, 683-697
2105557 CIF
Paper
N O PI 1 2/a 18.5194; 4.7448; 10.397
90; 90.013; 90
420.276Haines, J.; Chateau, C.; Léger, J. M.; Le Sauze, A.; Diot, N.; Marchand, R.; Hull, S.
Crystal structure of moganite-type phosphorus oxynitride: relationship to other twinned-quartz-based structures
Acta Crystallographica Section B, 1999, 55, 677-682
2105558 CIF
Paper
C6 H11 N3 O4P -111.585; 14.603; 4.8
89.28; 95.55; 104.484
782.5Pichon-Pesme, V.; Lecomte, C.
Experimental Charge Density and Electrostatic Potential of Triglycine
Acta Crystallographica Section B, 1998, 54, 485-493
2105559 CIF
Paper
Cs2 H3 O8 P SP 1 21/n 17.856; 7.732; 7.827
90; 99.92; 90
468.3Chisholm, Calum R. I.; Haile, Sossina M.
Structure and thermal behavior of the new superprotonic conductor Cs~2~(HSO~4~)(H~2~PO~4~)
Acta Crystallographica Section B, 1999, 55, 937-946
2105560 CIF
Paper
C14 H8 O2P 1 21/c 17.8684; 3.9634; 15.7839
90; 102.687; 90
480.21Fu, Y.; Brock, C. P.
Temperature Dependence of the Rigid-Body Motion of Anthraquinone
Acta Crystallographica Section B, 1998, 54, 308-315
2105561 CIF
Paper
C14 H8 O2P 1 21/c 17.8642; 3.9446; 15.748
90; 102.662; 90
476.64Fu, Y.; Brock, C. P.
Temperature Dependence of the Rigid-Body Motion of Anthraquinone
Acta Crystallographica Section B, 1998, 54, 308-315
2105562 CIF
Paper
C14 H8 O2P 1 21/c 17.8616; 3.928; 15.713
90; 102.616; 90
473.51Fu, Y.; Brock, C. P.
Temperature Dependence of the Rigid-Body Motion of Anthraquinone
Acta Crystallographica Section B, 1998, 54, 308-315
2105563 CIF
Paper
C14 H8 O2P 1 21/c 17.8621; 3.9121; 15.679
90; 102.591; 90
470.65Fu, Y.; Brock, C. P.
Temperature Dependence of the Rigid-Body Motion of Anthraquinone
Acta Crystallographica Section B, 1998, 54, 308-315
2105564 CIF
Paper
C14 H8 O2P 1 21/c 17.8674; 3.8948; 15.651
90; 102.548; 90
468.12Fu, Y.; Brock, C. P.
Temperature Dependence of the Rigid-Body Motion of Anthraquinone
Acta Crystallographica Section B, 1998, 54, 308-315
2105565 CIF
Paper
C15 H24 O9P -15.64; 8.571; 18.962
78.68; 84.34; 80.37
884.1Valente, E. J.; Fuller, J. F.; Ball, J. D.
Pseudoacids. I. 4- and 5-Oxoacids
Acta Crystallographica Section B, 1998, 54, 162-173
2105566 CIF
Paper
C7 H10 O5C 1 2/c 125.412; 6.291; 10.757
90; 104.84; 90
1662.3Valente, E. J.; Fuller, J. F.; Ball, J. D.
Pseudoacids. I. 4- and 5-Oxoacids
Acta Crystallographica Section B, 1998, 54, 162-173
2105567 CIF
Paper
C8 H10 O4P 42/n :215.83; 15.83; 7.016
90; 90; 90
1758Valente, E. J.; Fuller, J. F.; Ball, J. D.
Pseudoacids. I. 4- and 5-Oxoacids
Acta Crystallographica Section B, 1998, 54, 162-173
2105568 CIF
Paper
C4 H2 Cl2 O3P -16.277; 8.085; 12.369
99.5; 102.38; 90.29
604.2Valente, E. J.; Fuller, J. F.; Ball, J. D.
Pseudoacids. I. 4- and 5-Oxoacids
Acta Crystallographica Section B, 1998, 54, 162-173
2105569 CIF
Paper
C8 H6 O3P 1 21 14.006; 11.489; 7.347
90; 97.5; 90
335.25Valente, E. J.; Fuller, J. F.; Ball, J. D.
Pseudoacids. I. 4- and 5-Oxoacids
Acta Crystallographica Section B, 1998, 54, 162-173
2105570 CIF
Paper
C9 H8 O3P 21 21 215.199; 9.651; 15.95
90; 90; 90
800.3Valente, E. J.; Fuller, J. F.; Ball, J. D.
Pseudoacids. I. 4- and 5-Oxoacids
Acta Crystallographica Section B, 1998, 54, 162-173
2105571 CIF
Paper
C9 H8 O3P 1 21/n 14.651; 11.886; 14.312
90; 90.86; 90
791.1Valente, E. J.; Fuller, J. F.; Ball, J. D.
Pseudoacids. I. 4- and 5-Oxoacids
Acta Crystallographica Section B, 1998, 54, 162-173
2105572 CIF
Paper
C8 H5 Cl O2P b c a11.616; 8.12; 15.64
90; 90; 90
1475.2Valente, E. J.; Martin, S. B.; Sullivan, L. D.
Pseudoacids. II. 2-Acylbenzoic Acid Derivatives
Acta Crystallographica Section B, 1998, 54, 264-276
2105573 CIF
Paper
C15 H12 O3P 21 21 216.923; 8.291; 21.551
90; 90; 90
1237Valente, E. J.; Martin, S. B.; Sullivan, L. D.
Pseudoacids. II. 2-Acylbenzoic Acid Derivatives
Acta Crystallographica Section B, 1998, 54, 264-276
2105574 CIF
Paper
C17 H17 N O2P 21 21 218.662; 9.551; 17.649
90; 90; 90
1460.1Valente, E. J.; Martin, S. B.; Sullivan, L. D.
Pseudoacids. II. 2-Acylbenzoic Acid Derivatives
Acta Crystallographica Section B, 1998, 54, 264-276
2105575 CIF
Paper
C12 H13 N O3P -16.172; 11.163; 17.332
105.91; 99.85; 97.57
1111.2Valente, E. J.; Martin, S. B.; Sullivan, L. D.
Pseudoacids. II. 2-Acylbenzoic Acid Derivatives
Acta Crystallographica Section B, 1998, 54, 264-276
2105576 CIF
Paper
C18 H17 N O3P 1 21/c 16.844; 15.696; 14.154
90; 99.43; 90
1499.9Valente, E. J.; Martin, S. B.; Sullivan, L. D.
Pseudoacids. II. 2-Acylbenzoic Acid Derivatives
Acta Crystallographica Section B, 1998, 54, 264-276
2105577 CIF
Paper
C28 H18 O5P -19.694; 10.505; 11.163
80.58; 80.41; 76.49
1080.6Valente, E. J.; Martin, S. B.; Sullivan, L. D.
Pseudoacids. II. 2-Acylbenzoic Acid Derivatives
Acta Crystallographica Section B, 1998, 54, 264-276
2105578 CIF
Paper
C16 H10 O5I 1 2/a 115.31; 6.111; 28.3
90; 101.61; 90
2594Valente, E. J.; Martin, S. B.; Sullivan, L. D.
Pseudoacids. II. 2-Acylbenzoic Acid Derivatives
Acta Crystallographica Section B, 1998, 54, 264-276
2105579 CIF
Paper
C12 H13 N3 O2 SP 1 21/c 18.771; 13.344; 11.036
90; 108.314; 90
1226.2Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105580 CIF
Paper
C9 H13 N3 O2 SP b c a11.9723; 12.5938; 15.063
90; 90; 90
2271.2Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105581 CIF
Paper
C16 H13 N3 O2 SP 1 21/c 110.182; 11.923; 12.284
90; 107.23; 90
1424.4Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105582 CIF
Paper
C13 H13 N3 O2 SP 1 21/c 15.5561; 19.701; 12.143
90; 100.263; 90
1307.9Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105583 CIF
Paper
C12 H10 N2 O2 S2P 1 21/c 19.162; 11.121; 12.033
90; 104.388; 90
1187.6Lynch, Daniel E.; Nicholls, Laura J.; Smith, Graham; Byriel, Karl A.; Kennard, Colin H. L.
Molecular co-crystals of 2-aminothiazole derivatives
Acta Crystallographica Section B, 1999, 55, 758-766
2105584 CIF
Paper
C5 H6 O SP 1 21/a 16.848; 7.54; 11.111
90; 106.01; 90
551.5Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105585 CIF
Paper
C5 H6 O SP 21 21 216.641; 7.109; 11.594
90; 90; 90
547.4Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105586 CIF
Paper
C7 H8 O2 SP -17.5941; 7.8219; 7.9811
63.112; 64.66; 89.636
371.7Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105587 CIF
Paper
C5 H3 N O SP 1 21/n 17.516; 8.332; 9.059
90; 100.19; 90
558.4Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105588 CIF
Paper
C5 H6 O S2P n 21 a19.513; 8.083; 4.046
90; 90; 90
638.1Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105589 CIF
Paper
C9 H12 O SP 1 21/c 110.826; 17.065; 19.19
90; 91.011; 90
3544.7Blake, Alexander J.; Clark, Bernard A. J.; Gierens, Hedi; Gould, Robert O.; Hunter, Gordon A.; McNab, Hamish; Morrow, Mark; Sommerville, Craig C.
Intramolecular and intermolecular geometry of thiophenes with oxygen-containing substituents
Acta Crystallographica Section B, 1999, 55, 963-974
2105590 CIF
Paper
C13 H8 Cl2 OI 1 2/c 124.527; 6.064; 7.457
90; 100.1; 90
1091.9Mitkevich, V. V.; Lirtsman, V. G.; Strzhemechny, M. A.; Avdeenko, A. A.; Eremenko, V. V.
Investigation of the structural phase transitions near 190K in 4,4'-dichlorobenzophenone
Acta Crystallographica Section B, 1999, 55, 799-806
2105591 CIF
Paper
C32 H36 N2 Ni O8P 6118.498; 18.498; 16.328
90; 90; 120
4838.5Główka, M. L.; Olczak, A.; Karolak-Wojciechowska, J.; Ciechanowska-Urbańska, E.
Classification and Distortion in Six-Coordinate Bis(salicylaldiminato)nickel(II) Complexes: Crystal Structure of Bis[2-[[(2-hydroxyphenyl)methylene]amino]-1-phenyl-1,3-propanediolato]nickel(II).2H~2~O
Acta Crystallographica Section B, 1998, 54, 250-256
2105592 CIF
Paper
C27 H36 N2 O5P 1 21 113.706; 22.8; 30.674
90; 97.15; 90
9511Antolić, S.; Teichert, M.; Sheldrick, G.; Kojić-Prodić, B.; Čudić, M.; Horvat, Š.
Structure and molecular modelling of protected dipeptide fragment (Boc‒Phe‒Leu‒OBzl) of enkephalin
Acta Crystallographica Section B, 1999, 55, 975-984
2105593 CIF
Paper
Cr O4 Rb2P n a m7.976; 10.692; 6.057
90; 90; 90
516.5Aleksovska, S.; Nyburg, S. C.; Pejov, Lj.; Petrusevski, V. M.
β-K~2~SO~4~-Type Isomorphs: Prediction of Structures and Refinement of Rb~2~CrO~4~
Acta Crystallographica Section B, 1998, 54, 115-120
2105594 CIF
Paper
C8 H16 N4 O6P 1 21/c 15.1107; 23.937; 10.947
90; 116.91; 90
1194.2Chandra, N. R.; Prabu, M. M.; Venkatraman, J.; Suresh, S.; Vijayan, M.
X-ray Studies on Crystalline Complexes Involving Amino Acids and Peptides. XXXIII. Crystal Structures of <small>L</small>- and <small>DL</small>-Arginine Complexed with Oxalic Acid and a Comparative Study of Amino Acid‒Oxalic Acid Complexes
Acta Crystallographica Section B, 1998, 54, 257-263
2105595 CIF
Paper
C8 H16 N4 O6P 15.0668; 9.7572; 13.141
111.11; 92.75; 91.97
604.4Chandra, N. R.; Prabu, M. M.; Venkatraman, J.; Suresh, S.; Vijayan, M.
X-ray Studies on Crystalline Complexes Involving Amino Acids and Peptides. XXXIII. Crystal Structures of <small>L</small>- and <small>DL</small>-Arginine Complexed with Oxalic Acid and a Comparative Study of Amino Acid‒Oxalic Acid Complexes
Acta Crystallographica Section B, 1998, 54, 257-263
2105596 CIF
Paper
C12 H13 N OP 1 21/c 16.112; 11.173; 14.428
90; 90.79; 90
985.2Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105597 CIF
Paper
C13 H15 N O2P 1 21/n 15.226; 14.047; 16.134
90; 96.48; 90
1176.8Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105598 CIF
Paper
C12 H12 Cl N OP 1 21/c 15.908; 13.583; 14.058
90; 96.18; 90
1121.6Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105599 CIF
Paper
C14 H17 N O2P 1 21/n 17.079; 15.996; 11.231
90; 92.78; 90
1270.3Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105600 CIF
Paper
C14 H17 N O2P 1 21/n 15.604; 13.667; 16.742
90; 95.02; 90
1277.3Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105601 CIF
Paper
C11 H19 N OP -17.139; 9.08; 9.194
106.22; 92.33; 97.9
564.9Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105602 CIF
Paper
C14 H17 N OP 1 21/a 19.493; 13.061; 10.305
90; 105.51; 90
1231.2Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105603 CIF
Paper
C15 H19 N O2P n a 2127.458; 7.18; 14.21
90; 90; 90
2801.5Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105604 CIF
Paper
C20 H33 N3 O2C 1 2/c 131.779; 5.714; 11.334
90; 92.76; 90
2055.7Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105605 CIF
Paper
C14 H17 N OP -19.608; 11.248; 12.096
106.38; 91.22; 98.91
1236.1Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105606 CIF
Paper
C15 H19 N O2P b c a10.546; 14.205; 18.323
90; 90; 90
2744.9Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105607 CIF
Paper
C14 H16 Cl N OP 1 21 17.313; 11.778; 8.017
90; 107.26; 90
659.43Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105608 CIF
Paper
C14 H16 Cl N OP -19.756; 11.983; 12.043
101.53; 91.99; 98.83
1360Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105609 CIF
Paper
C18 H14 Cl2 N2 OP b c a14.244; 9.645; 23.711
90; 90; 90
3257.5Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105610 CIF
Paper
C17 H12 Cl N O2P 1 21/a 17.075; 13.332; 15.03
90; 95.17; 90
1411.9Bertolasi, V.; Gilli, P.; Ferretti, V.; Gilli, G.
Intermolecular N-H···O Hydrogen Bonding Assisted by Resonance. II. Self Assembly of Hydrogen-Bonded Secondary Enaminones in Supramolecular Catemers
Acta Crystallographica Section B, 1998, 54, 50-65
2105611 CIF
Paper
C4 H3 N3 OP n a 2112.584; 9.699; 3.674
90; 90; 90
448.4Bianchi, R.; Gervasio, G.; Viscardi, G.
Experimental Electron-Density Study of 4-Cyanoimidazolium-5-olate at 120 K
Acta Crystallographica Section B, 1998, 54, 66-72
2105612 CIF
Paper
C4 H3 N3 OP n a 2112.584; 9.699; 3.674
90; 90; 90
448.4Bianchi, R.; Gervasio, G.; Viscardi, G.
Experimental Electron-Density Study of 4-Cyanoimidazolium-5-olate at 120 K
Acta Crystallographica Section B, 1998, 54, 66-72
2105613 CIF
Paper
C4 H3 N3 OP n a 2112.584; 9.699; 3.674
90; 90; 90
448.4Bianchi, R.; Gervasio, G.; Viscardi, G.
Experimental Electron-Density Study of 4-Cyanoimidazolium-5-olate at 120 K
Acta Crystallographica Section B, 1998, 54, 66-72
2105614 CIF
Paper
C25 H33 NP 1 21/c 113.667; 16.414; 9.409
90; 94.54; 90
2104.1Kumaran, D.; Ponnuswamy, M. N.; Shanmugam, G.; Ponnuswamy, S.; Jeyaraman, R.; Shivakumar, K.; Fun, H.-K.
Molecular structures and conformations of three 3-azabicyclononanes
Acta Crystallographica Section B, 1999, 55, 793-798
2105615 CIF
Paper
C22 H25 N OP b c a14.687; 12.931; 18.564
90; 90; 90
3525.6Kumaran, D.; Ponnuswamy, M. N.; Shanmugam, G.; Ponnuswamy, S.; Jeyaraman, R.; Shivakumar, K.; Fun, H.-K.
Molecular structures and conformations of three 3-azabicyclononanes
Acta Crystallographica Section B, 1999, 55, 793-798
2105616 CIF
Paper
C23 H29 N OP 1 21/n 17.638; 13.188; 18.865
90; 97.94; 90
1882.1Kumaran, D.; Ponnuswamy, M. N.; Shanmugam, G.; Ponnuswamy, S.; Jeyaraman, R.; Shivakumar, K.; Fun, H.-K.
Molecular structures and conformations of three 3-azabicyclononanes
Acta Crystallographica Section B, 1999, 55, 793-798
2105617 CIF
Paper
C24 H25 Cl N4P 1 21/c 18.19; 14.463; 18.115
90; 96.2; 90
2133.2Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Fernàndez-Castaño, Cristina
Self-assembly of N<i>H</i>-pyrazoles <i>via</i> intermolecular N—H···N hydrogen bonds
Acta Crystallographica Section B, 1999, 55, 985-993
2105618 CIF
Paper
C8 H10 N4 OP b c n16.409; 7.619; 13.544
90; 90; 90
1693.3Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Fernàndez-Castaño, Cristina
Self-assembly of N<i>H</i>-pyrazoles <i>via</i> intermolecular N—H···N hydrogen bonds
Acta Crystallographica Section B, 1999, 55, 985-993
2105619 CIF
Paper
C11 H8 N4 OP 1 21/n 17.196; 14.125; 10.862
90; 97.34; 90
1095Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105620 CIF
Paper
C11 H11 N3 OP 1 21/n 17.052; 13.211; 11.996
90; 104.96; 90
1079.7Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105621 CIF
Paper
C12 H11 N3 O2P 1 21/n 18.638; 10.841; 12.208
90; 94.69; 90
1139.4Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105622 CIF
Paper
C11 H11 N3 O2P n m a15.236; 6.618; 11.379
90; 90; 90
1147.4Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105623 CIF
Paper
C12 H11 N3 O2P -16.878; 8.241; 11.395
105.21; 96.62; 102.92
597Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105624 CIF
Paper
C10 H8 N4 O3P 1 21/n 17.184; 19.491; 8.084
90; 109.27; 90
1068.5Bertolasi, Valerio; Gilli, Paola; Ferretti, Valeria; Gilli, Gastone; Vaughan, Keith; Jollimore, Jason V.
Interplay of hydrogen bonding and other molecular interactions in determining the crystal packing of a series of <i>anti</i>-β-ketoarylhydrazones
Acta Crystallographica Section B, 1999, 55, 994-1004
2105625 CIF
Paper
C16 H23 N2 OP 1 21/c 112.684; 11.74; 11.024
90; 111.4; 90
1528.4Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105626 CIF
Paper
C16 H23 N2 OP 1 21/c 112.5774; 11.6228; 10.8229
90; 110.853; 90
1478.5Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105627 CIF
Paper
C17 H25 N2 O SP 1 21/c 113.5737; 11.8796; 11.1628
90; 98.76; 90
1779Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105628 CIF
Paper
C15 H22 N3 OP 1 21/c 112.425; 11.598; 11.038
90; 109.53; 90
1499.1Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105629 CIF
Paper
C17 H25 N2 OP 1 21/c 112.49; 11.597; 11.28
90; 97.12; 90
1621.3Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105630 CIF
Paper
C17 H25 N2 OP 1 21/c 112.4422; 11.495; 11.094
90; 97.381; 90
1573.6Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105631 CIF
Paper
C20 H25 N2 OP n a 2120.0837; 5.6969; 15.106
90; 90; 90
1728.4Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105632 CIF
Paper
C22 H27 N2 O2P c a 2130.565; 5.993; 22.032
90; 90; 90
4036Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105633 CIF
Paper
C17 H25 N2 O3 SP 1 21/c 111.1835; 15.487; 11.566
90; 114.539; 90
1822.3Iwasaki, Fujiko; Yoshikawa, Joseph H.; Yamamoto, Hajime; Takada, Kiwamu; Kan-nari, Eiji; Yasui, Masanori; Ishida, Takayuki; Nogami, Takashi
TEMPO radicals showing magnetic interactions. II. 4-(Benzylideneamino)-TEMPO and related compounds
Acta Crystallographica Section B, 1999, 55, 1057-1067
2105634 CIF
Paper
O12 Re2 Tm5C 1 2/m 112.3717; 5.6744; 7.4805
90; 107.816; 90
499.96Ehrenberg, H.; Hartmann, T.; Wltschek, G.; Fuess, H.; Morgenroth, W.; Krane, H.-G.
The crystal structure of Tm~5~Re~2~O~12~
Acta Crystallographica Section B, 1999, 55, 849-852
2105635 CIF
Paper
Cl2 H8 Ni O4P 1 21/n 15.985; 9.291; 10.931
90; 100.32; 90
598Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.
Charge density in NiCl~2~.4H~2~O at 295 and 30K
Acta Crystallographica Section B, 1999, 55, 830-840
2105636 CIF
Paper
Cl2 H8 Ni O4P 1 21/n 16.006; 9.338; 10.986
90; 100.45; 90
605.9Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.
Charge density in NiCl~2~.4H~2~O at 295 and 30K
Acta Crystallographica Section B, 1999, 55, 830-840
2105637 CIF
Paper
Cl2 H8 Ni O4P 1 21/n 15.961; 9.273; 10.891
90; 100.02; 90
592.8Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.
Charge density in NiCl~2~.4H~2~O at 295 and 30K
Acta Crystallographica Section B, 1999, 55, 830-840
2105638 CIF
Paper
Cl2 H8 Ni O4P 1 21/n 15.968; 9.283; 10.897
90; 100.08; 90
594.4Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.
Charge density in NiCl~2~.4H~2~O at 295 and 30K
Acta Crystallographica Section B, 1999, 55, 830-840
2105639 CIF
Paper
C4 H16 Cl4 Co N2P 1 21/n 18.5313; 11.4382; 13.307
90; 90.038; 90
1298.53Mahmoudkhani, Amir H.; Langer, Vratislav
Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures
Acta Crystallographica Section B, 1999, 55, 752-757
2105640 CIF
Paper
C4 H16 Cl4 Co N2P 1 21/n 18.5513; 11.4527; 13.3364
90; 90.01; 90
1306.11Mahmoudkhani, Amir H.; Langer, Vratislav
Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures
Acta Crystallographica Section B, 1999, 55, 752-757
2105641 CIF
Paper
C4 H16 Cl4 Co N2P 1 21/n 18.564; 11.4573; 13.359
90; 90.037; 90
1310.79Mahmoudkhani, Amir H.; Langer, Vratislav
Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures
Acta Crystallographica Section B, 1999, 55, 752-757
2105642 CIF
Paper
C4 H16 Cl4 Co N2P 1 21/n 18.5775; 11.4679; 13.3855
90; 90.021; 90
1316.68Mahmoudkhani, Amir H.; Langer, Vratislav
Structure of [(CH~3~)~2~NH~2~]~2~CoCl~4~ at elevated temperatures
Acta Crystallographica Section B, 1999, 55, 752-757
2105643 CIF
Paper
As O5 Rb TiP n a 2113.218; 6.65; 10.761
90; 90; 90
945.89Almgren, Jenni; Streltsov, Victor A.; Sobolev, Alexander N.; Figgis, Brian N.; Albertsson, Jörgen
Structure of and electron density in RbTiOAsO~4~ at 9.6K
Acta Crystallographica Section B, 1999, 55, 712-720
2105644 CIF
Paper
As O5 Rb TiP n a 2113.261; 6.6791; 10.769
90; 90; 90
953.8Almgren, Jenni; Streltsov, Victor A.; Sobolev, Alexander N.; Figgis, Brian N.; Albertsson, Jörgen
Structure of and electron density in RbTiOAsO~4~ at 9.6K
Acta Crystallographica Section B, 1999, 55, 712-720
2105645 CIF
Paper
C5 H10 N2 O4P 21 21 217.275; 9.097; 10.507
90; 90; 90
695.4Görbitz, Carl Henrik
What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal
Acta Crystallographica Section B, 1999, 55, 1090-1098
2105646 CIF
Paper
C5 H10 N2 O4P 21 21 217.275; 9.097; 10.507
90; 90; 90
695.4Görbitz, Carl Henrik
What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal
Acta Crystallographica Section B, 1999, 55, 1090-1098
2105647 CIF
Paper
C5 H10 N2 O4P 21 21 217.275; 9.097; 10.507
90; 90; 90
695.4Görbitz, Carl Henrik
What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal
Acta Crystallographica Section B, 1999, 55, 1090-1098
2105648 CIF
Paper
C5 H10 N2 O4P 21 21 217.275; 9.097; 10.507
90; 90; 90
695.4Görbitz, Carl Henrik
What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal
Acta Crystallographica Section B, 1999, 55, 1090-1098
2105649 CIF
Paper
C5 H10 N2 O4P 21 21 217.275; 9.097; 10.507
90; 90; 90
695.4Görbitz, Carl Henrik
What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal
Acta Crystallographica Section B, 1999, 55, 1090-1098
2105650 CIF
Paper
C5 H10 N2 O4P 21 21 217.275; 9.097; 10.507
90; 90; 90
695.4Görbitz, Carl Henrik
What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal
Acta Crystallographica Section B, 1999, 55, 1090-1098
2105651 CIF
Paper
C5 H10 N2 O4P 21 21 217.275; 9.097; 10.507
90; 90; 90
695.4Görbitz, Carl Henrik
What is the best crystal size for collection of X-ray data? Refinement of the structure of glycyl-<small>L</small>-serine based on data from a very large crystal
Acta Crystallographica Section B, 1999, 55, 1090-1098
2105652 CIF
Paper
C31 H90 F2 N16 O10P 1 21/c 18.56; 16.301; 37.004
90; 92.31; 90
5159.2Li, Q.; Mak, T. C. W.
Hydrogen-Bonded Urea‒Anion Host Lattices. 6. New Inclusion Compounds of Urea with Tetra-<i>n</i>-propylammonium Halides
Acta Crystallographica Section B, 1998, 54, 180-192
2105653 CIF
Paper
C14 H36 Cl N5 O2P 1 21/n 19.839; 15.16; 14.583
90; 108.82; 90
2058.9Li, Q.; Mak, T. C. W.
Hydrogen-Bonded Urea‒Anion Host Lattices. 6. New Inclusion Compounds of Urea with Tetra-<i>n</i>-propylammonium Halides
Acta Crystallographica Section B, 1998, 54, 180-192
2105654 CIF
Paper
C15 H40 Cl N7 O3P 1 21/c 19.866; 16.274; 15.277
90; 103.36; 90
2386.5Li, Q.; Mak, T. C. W.
Hydrogen-Bonded Urea‒Anion Host Lattices. 6. New Inclusion Compounds of Urea with Tetra-<i>n</i>-propylammonium Halides
Acta Crystallographica Section B, 1998, 54, 180-192
2105655 CIF
Paper
C15 H42 Br N7 O4P -18.857; 10.639; 15.115
88.01; 75.02; 66.72
1260.2Li, Q.; Mak, T. C. W.
Hydrogen-Bonded Urea‒Anion Host Lattices. 6. New Inclusion Compounds of Urea with Tetra-<i>n</i>-propylammonium Halides
Acta Crystallographica Section B, 1998, 54, 180-192
2105656 CIF
Paper
C15 H42 I N7 O4P -19.045; 10.781; 15.169
87.98; 76; 65.73
1305Li, Q.; Mak, T. C. W.
Hydrogen-Bonded Urea‒Anion Host Lattices. 6. New Inclusion Compounds of Urea with Tetra-<i>n</i>-propylammonium Halides
Acta Crystallographica Section B, 1998, 54, 180-192
2105657 CIF
Paper
C96.5 H158 N18 O26.5P -111.253; 19.657; 28.546
105.32; 98.03; 100.92
5858Geßmann, R.; Brückner, H.; Kokkinidis, M.
Structure of <i>Z</i>-(Aib)~9~OBu^<i>t^</i>
Acta Crystallographica Section B, 1998, 54, 300-307
2105658 CIF
Paper
Br4 Cs2 HgP n 21 a10.27; 7.946; 13.935
90; 90; 90
1137.2Pinheiro, C. B.; Jório, A.; Pimenta, M. A.; Speziali, N. L.
Structural Analysis of Cs~2~HgBr~4~ in Normal, Incommensurate and Twinned Phases
Acta Crystallographica Section B, 1998, 54, 197-203
2105659 CIF
Paper
Br4 Cs2 HgP n m a10.27; 7.946; 13.935
90; 90; 90
1137.2Pinheiro, C. B.; Jório, A.; Pimenta, M. A.; Speziali, N. L.
Structural Analysis of Cs~2~HgBr~4~ in Normal, Incommensurate and Twinned Phases
Acta Crystallographica Section B, 1998, 54, 197-203
2105660 CIF
Paper
Br4 Cs2 HgP n m a10.27; 7.946; 13.935
90; 90; 90
1137.2Pinheiro, C. B.; Jório, A.; Pimenta, M. A.; Speziali, N. L.
Structural Analysis of Cs~2~HgBr~4~ in Normal, Incommensurate and Twinned Phases
Acta Crystallographica Section B, 1998, 54, 197-203
2105661 CIF
Paper
Br4 Cs2 HgP n m a10.24; 7.9; 13.888
90; 90; 90
1123.5Pinheiro, C. B.; Jório, A.; Pimenta, M. A.; Speziali, N. L.
Structural Analysis of Cs~2~HgBr~4~ in Normal, Incommensurate and Twinned Phases
Acta Crystallographica Section B, 1998, 54, 197-203
2105662 CIF
Paper
Br4 Cs2 HgP 21/n 1 110.231; 7.873; 13.906
90; 90; 90
1120.1Pinheiro, C. B.; Jório, A.; Pimenta, M. A.; Speziali, N. L.
Structural Analysis of Cs~2~HgBr~4~ in Normal, Incommensurate and Twinned Phases
Acta Crystallographica Section B, 1998, 54, 197-203
2105663 CIF
Paper
C4 H6 N4 Na2 Ni O3P -17.278; 8.856; 15.131
89.32; 87.39; 83.61
968.2Ptasiewicz-Bak, H.; Olovsson, I.; McIntyre, G. J.
Structure, Charge and Spin Density in Na~2~Ni(CN)~4~.3H~2~O at 295 and 30 K
Acta Crystallographica Section B, 1998, 54, 600-612
2105664 CIF
Paper
C73 H8 Br2P 1 21/m 19.863; 17.36; 11.19
90; 102.44; 90
1871Iversen, B. B.; Darovsky, A.; Bolotovsky, R.; Coppens, P.
Low-Temperature Synchrotron Radiation Study of a Twinned Disordered Crystal of Bis(4,4'-bromophenyl)-61,61-diyl Methano Fullerene C~60~
Acta Crystallographica Section B, 1998, 54, 174-179
2105665 CIF
Paper
C73 H8 Br2P 1 21/m 19.863; 17.36; 11.19
90; 102.44; 90
1871Iversen, B. B.; Darovsky, A.; Bolotovsky, R.; Coppens, P.
Low-Temperature Synchrotron Radiation Study of a Twinned Disordered Crystal of Bis(4,4'-bromophenyl)-61,61-diyl Methano Fullerene C~60~
Acta Crystallographica Section B, 1998, 54, 174-179
2105666 CIF
Paper
C2 H6 O6P 1 21/n 16.1024; 3.4973; 11.9586
90; 105.771; 90
245.612Martin, A.; Pinkerton, A. A.
Charge Density Studies Using CCD Detectors: Oxalic Acid at 100 K Revisited
Acta Crystallographica Section B, 1998, 54, 471-477
2105667 CIF
Paper
C2 H6 O6P 1 21/n 16.1024; 3.4973; 11.9586
90; 105.771; 90
245.612Martin, A.; Pinkerton, A. A.
Charge Density Studies Using CCD Detectors: Oxalic Acid at 100 K Revisited
Acta Crystallographica Section B, 1998, 54, 471-477
2105668 CIF
Paper
C2 H6 O6P 1 21/n 16.1024; 3.4973; 11.9586
90; 105.771; 90
245.612Martin, A.; Pinkerton, A. A.
Charge Density Studies Using CCD Detectors: Oxalic Acid at 100 K Revisited
Acta Crystallographica Section B, 1998, 54, 471-477
2105669 CIF
Paper
Eu0.976 Mo7.1 O14 V1.13Cmca(00\g)s0011.306; 10.025; 9.254
90; 90; 90
1048.87Leligny, H.; Grebille, D.; Roussel, P.; Labbé, Ph.; Hervieu, M.; Raveau, B.; Tortelier, J.; Gougeon, P.
Cluster configurations in modulated EuV~<i>x~</i>Mo~8{±~<i>y</i>}O~14~ crystals
Acta Crystallographica Section B, 1999, 55, 467-483
2105670 CIF
Paper
Eu0.986 Mo7.3 O14 V1.1Cmca(00\g)s0011.325; 10.024; 9.24
90; 90; 90
1048.94Leligny, H.; Grebille, D.; Roussel, P.; Labbé, Ph.; Hervieu, M.; Raveau, B.; Tortelier, J.; Gougeon, P.
Cluster configurations in modulated EuV~<i>x~</i>Mo~8{±~<i>y</i>}O~14~ crystals
Acta Crystallographica Section B, 1999, 55, 467-483
2105671 CIF
Paper
Eu Mo7.96 O14Cmca(00\g)s0011.315; 10.035; 9.265
90; 90; 90
1052Leligny, H.; Grebille, D.; Roussel, P.; Labbé, Ph.; Hervieu, M.; Raveau, B.; Tortelier, J.; Gougeon, P.
Cluster configurations in modulated EuV~<i>x~</i>Mo~8{±~<i>y</i>}O~14~ crystals
Acta Crystallographica Section B, 1999, 55, 467-483
2105672 CIF
Paper
Cu8 Ge S6P m n 219.9073; 9.9073; 9.8703
90; 90; 90.642
968.75Onoda, Mitsuko; Chen, Xue-An; Kato, Katsuo; Sato, Akira; Wada, Hiroaki
Structure refinement of Cu~8~GeS~6~ using X-ray diffraction data from a multiple-twinned crystal
Acta Crystallographica Section B, 1999, 55, 721-725
2105673 CIF
Paper
Cl4 Cs2 HgP n m a9.789; 7.541; 13.418
90; 90; 90
990.5Bagautdinov, Bagautdin; Pilz, Katrin; Ludecke, Jens; van Smaalen, Sander
Modulated structures of Cs~2~HgCl~4~: the 5<i>a</i> superstructure at 185 K and the 3<i>c</i> superstructure at 176 K
Acta Crystallographica Section B, 1999, 55, 886-895
2105674 CIF
Paper
Cl4 Cs2 HgP n m a9.7729; 7.5276; 13.3727
90; 90; 90
983.78Bagautdinov, Bagautdin; Pilz, Katrin; Ludecke, Jens; van Smaalen, Sander
Modulated structures of Cs~2~HgCl~4~: the 5<i>a</i> superstructure at 185 K and the 3<i>c</i> superstructure at 176 K
Acta Crystallographica Section B, 1999, 55, 886-895
2105675 CIF
HKL
Paper
C10 H10 O2P 1 21/c 18.006; 5.482; 19.444
90; 110.46; 90
799.5Herbstein, Frank H.; Iversen, Bo Brummerstedt; Kapon, Moshe; Larsen, Finn Krebs; Madsen, Georg Kent Hellerup; Reisner, George M.
X-ray and neutron diffraction study of benzoylacetone in the temperature range 8–300 K: comparison with other <i>cis</i>-enol molecules
Acta Crystallographica Section B, 1999, 55, 767-787
2105676 CIF
HKL
Paper
C10 H10 O2P 1 21/c 18.027; 5.483; 19.478
90; 110.42; 90
803.4Herbstein, Frank H.; Iversen, Bo Brummerstedt; Kapon, Moshe; Larsen, Finn Krebs; Madsen, Georg Kent Hellerup; Reisner, George M.
X-ray and neutron diffraction study of benzoylacetone in the temperature range 8–300 K: comparison with other <i>cis</i>-enol molecules
Acta Crystallographica Section B, 1999, 55, 767-787
2105677 CIF
Paper
C2 H2 Cl Li O2P 1 21/c 19.3882; 4.8452; 9.0119
90; 94.33; 90
408.76Ehrenberg, H.; Hasse, B.; Schwarz, K.; Epple, M.
Structure determination of lithium chloroacetate, lithium bromoacetate and lithium iodoacetate by powder diffraction
Acta Crystallographica Section B, 1999, 55, 517-524
2105678 CIF
Paper
C2 H2 Br Li O2P 1 21/c 19.7165; 4.861; 9.0228
90; 93.946; 90
425.15Ehrenberg, H.; Hasse, B.; Schwarz, K.; Epple, M.
Structure determination of lithium chloroacetate, lithium bromoacetate and lithium iodoacetate by powder diffraction
Acta Crystallographica Section B, 1999, 55, 517-524
2105679 CIF
Paper
C2 H2 I Li O2P 1 21/c 110.1812; 4.8922; 9.0468
90; 93.251; 90
449.88Ehrenberg, H.; Hasse, B.; Schwarz, K.; Epple, M.
Structure determination of lithium chloroacetate, lithium bromoacetate and lithium iodoacetate by powder diffraction
Acta Crystallographica Section B, 1999, 55, 517-524
2105681 CIF
Paper
O1.879 Y0.242 Zr0.758F m -3 m5.15463; 5.15463; 5.15463
90; 90; 90
136.96Ishizawa, N.; Matsushima, Y.; Hayashi, M.; Ueki, M.
Synchrotron radiation study of yttria-stabilized zirconia, Zr~0.758~Y~0.242~O~1.879~
Acta Crystallographica Section B, 1999, 55, 726-735
2105682 CIF
Paper
O1.879 Y0.242 Zr0.758F m -3 m5.15463; 5.15463; 5.15463
90; 90; 90
136.96Ishizawa, N.; Matsushima, Y.; Hayashi, M.; Ueki, M.
Synchrotron radiation study of yttria-stabilized zirconia, Zr~0.758~Y~0.242~O~1.879~
Acta Crystallographica Section B, 1999, 55, 726-735
2105683 CIF
Paper
C4 H10 Ag2 N4 O10P 1 21 15.451; 19.493; 5.441
90; 100.12; 90
569.1Choudhury, R. R.; Chitra, R.; Aliouane, N.; Schefer, J.
Ferroelectric glycine silver nitrate: a single-crystal neutron diffraction study
Acta Crystallographica Section B, 2013, 69, 595-602
2105684 CIF
Paper
C4 H10 Ag2 N4 O10P 1 21/a 15.451; 19.493; 5.541
90; 100.2; 90
579.5Choudhury, R. R.; Chitra, R.; Aliouane, N.; Schefer, J.
Ferroelectric glycine silver nitrate: a single-crystal neutron diffraction study
Acta Crystallographica Section B, 2013, 69, 595-602
2105685 CIF
Paper
Mg2 O6 Si2C 1 2/c 19.5387; 8.6601; 5.262
90; 108.701; 90
411.72Yoshiasa, Akira; Nakatsuka, Akihiko; Okube, Maki; Katsura, Tomoo
Single-crystal metastable high-temperature <i>C</i>2/<i>c</i> clinoenstatite quenched rapidly from high temperature and high pressure
Acta Crystallographica Section B, 2013, 69, 541-546
2105686 CIF
Paper
C9 H18 N3 S6 SbP -110.8746; 11.2843; 15.0197
99.886; 96.852; 94.714
1792.8Chauhan, H. P. S.; Carpenter, Jaswant
Supramolecular association <i>via</i> Sb···S and C—H···S interactions in dimeric <i>tris</i>(<i>N</i>,<i>N</i>-dimethyldithiocarbamato-<i>S</i>,<i>S</i>')antimony(III): an approach to overcome the concept of steric bulk on such interactions
Acta Crystallographica Section B, 2013, 69, 613-620
2105687 CIF
Paper
Sn6.97 Tb3P m m m4.3352; 4.4251; 26.7006
90; 90; 90
512.22Oshchapovsky, Igor; Pavlyuk, Volodymyr; Chumak, Igor
Tb~3~Sn~7~: polymorphism and crystal structure of high-temperature modification
Acta Crystallographica Section B, 2013, 69, 527-533
2105688 CIF
Paper
C11 H12 N O4 PP 21 21 219.2532; 10.1555; 12.661
90; 90; 90
1189.8Małecka, Magdalena; Mondal, Swastik; van Smaalen, Sander; Paulmann, Carsten
Charge density distribution of 3-(1-aminoethylidene)-2-methoxy-2-oxo-2,3-dihydro-2λ^5^-benzo[<i>e</i>][1,2]oxaphosphinin-4-one
Acta Crystallographica Section B, 2013, 69, 621-628
2105689 CIF
Paper
F Mn Na O4 SC 1 2/c 113.77027; 6.63687; 10.35113
90; 121.479; 90
806.779Barpanda, Prabeer; Ling, Chris D.; Oyama, Gosuke; Yamada, Atsuo
Sodium manganese fluorosulfate with a triplite structure
Acta Crystallographica Section B, 2013, 69, 584-588
2105690 CIF
Paper
C6 H10 N Na O3P 1 21/c 113.8784; 8.3444; 6.9228
90; 92.832; 90
800.73Clegg, William; Tooke, Duncan M.
Alkali metal complexes of 6-methyl-2-pyridone: simple formulae, but not so simple structures
Acta Crystallographica Section B, 2013, 69, 603-612
2105691 CIF
Paper
C6 H10 K N O3P c c n8.2804; 28.818; 7.2304
90; 90; 90
1725.4Clegg, William; Tooke, Duncan M.
Alkali metal complexes of 6-methyl-2-pyridone: simple formulae, but not so simple structures
Acta Crystallographica Section B, 2013, 69, 603-612
2105692 CIF
Paper
C6 H8 N O2 RbP 1 21/c 113.9109; 7.8661; 7.0235
90; 98.8733; 90
759.35Clegg, William; Tooke, Duncan M.
Alkali metal complexes of 6-methyl-2-pyridone: simple formulae, but not so simple structures
Acta Crystallographica Section B, 2013, 69, 603-612
2105693 CIF
Paper
C6 H8 Cs N O2P 1 21/c 114.174; 8.2056; 7.0984
90; 100.605; 90
811.5Clegg, William; Tooke, Duncan M.
Alkali metal complexes of 6-methyl-2-pyridone: simple formulae, but not so simple structures
Acta Crystallographica Section B, 2013, 69, 603-612
2105694 CIF
Paper
C7 H10 Cs N O2P 1 21/c 110.764; 12.106; 7.1736
90; 92.363; 90
934Clegg, William; Tooke, Duncan M.
Alkali metal complexes of 6-methyl-2-pyridone: simple formulae, but not so simple structures
Acta Crystallographica Section B, 2013, 69, 603-612
2105695 CIF
Paper
C8 H12 Cs N O2P 1 21/c 111.6376; 24.98; 7.2431
90; 100.756; 90
2068.6Clegg, William; Tooke, Duncan M.
Alkali metal complexes of 6-methyl-2-pyridone: simple formulae, but not so simple structures
Acta Crystallographica Section B, 2013, 69, 603-612
2105696 CIFC2 H5 N O2P 1 21/n 15.0993; 11.9416; 5.4608
90; 111.784; 90
308.78Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P.
Structural characterization of crystals of α-glycine during anomalous electrical behaviour
Acta Crystallographica Section B Structural Science, 2002, 58, 728
2105697 CIFC2 H5 N O2P 1 21/n 15.0999; 11.9516; 5.4594
90; 111.781; 90
309Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P.
Structural characterization of crystals of α-glycine during anomalous electrical behaviour
Acta Crystallographica Section B Structural Science, 2002, 58, 728
2105698 CIFC2 H5 N O2P 1 21/n 15.1008; 11.9558; 5.4602
90; 111.772; 90
309.23Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P.
Structural characterization of crystals of α-glycine during anomalous electrical behaviour
Acta Crystallographica Section B Structural Science, 2002, 58, 728
2105699 CIFC2 H5 N O2P 1 21/n 15.1012; 11.9651; 5.4604
90; 111.763; 90
309.53Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P.
Structural characterization of crystals of α-glycine during anomalous electrical behaviour
Acta Crystallographica Section B Structural Science, 2002, 58, 728
2105700 CIFC2 H5 N O2P 1 21/n 15.1026; 11.9752; 5.4602
90; 111.757; 90
309.88Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P.
Structural characterization of crystals of α-glycine during anomalous electrical behaviour
Acta Crystallographica Section B Structural Science, 2002, 58, 728
2105701 CIFC2 H5 N O2P 1 21/n 15.1074; 12.0775; 5.4596
90; 111.827; 90
312.63Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P.
Structural characterization of crystals of α-glycine during anomalous electrical behaviour
Acta Crystallographica Section B Structural Science, 2002, 58, 728
2105702 CIFC3 H4 OP b c a6.97; 9.514; 9.752
90; 90; 90
646.7Day, Graeme M.; Cooper, Timothy G.; Cruz-Cabeza, Aurora J.; Hejczyk, Katarzyna E.; Ammon, Herman L.; Boerrigter, Stephan X. M.; Tan, Jeffrey S.; Della Valle, Raffaele G.; Venuti, Elisabetta; Jose, Jovan; Gadre, Shridhar R.; Desiraju, Gautam R.; Thakur, Tejender S.; van Eijck, Bouke P.; Facelli, Julio C.; Bazterra, Victor E.; Ferraro, Marta B.; Hofmann, Detlef W. M.; Neumann, Marcus A.; Leusen, Frank J. J.; Kendrick, John; Price, Sarah L.; Misquitta, Alston J.; Karamertzanis, Panagiotis G.; Welch, Gareth W. A.; Scheraga, Harold A.; Arnautova, Yelena A.; Schmidt, Martin U.; van de Streek, Jacco; Wolf, Alexandra K.; Schweizer, Bernd
Significant progress in predicting the crystal structures of small organic molecules ‒ a report on the fourth blind test
Acta Crystallographica Section B Structural Science, 2009, 65, 107-125
2105703 CIFC6 H2 Br2 Cl FP 1 21/c 13.8943; 13.5109; 14.4296
90; 93.636; 90
757.69Day, Graeme M.; Cooper, Timothy G.; Cruz-Cabeza, Aurora J.; Hejczyk, Katarzyna E.; Ammon, Herman L.; Boerrigter, Stephan X. M.; Tan, Jeffrey S.; Della Valle, Raffaele G.; Venuti, Elisabetta; Jose, Jovan; Gadre, Shridhar R.; Desiraju, Gautam R.; Thakur, Tejender S.; van Eijck, Bouke P.; Facelli, Julio C.; Bazterra, Victor E.; Ferraro, Marta B.; Hofmann, Detlef W. M.; Neumann, Marcus A.; Leusen, Frank J. J.; Kendrick, John; Price, Sarah L.; Misquitta, Alston J.; Karamertzanis, Panagiotis G.; Welch, Gareth W. A.; Scheraga, Harold A.; Arnautova, Yelena A.; Schmidt, Martin U.; van de Streek, Jacco; Wolf, Alexandra K.; Schweizer, Bernd
Significant progress in predicting the crystal structures of small organic molecules ‒ a report on the fourth blind test
Acta Crystallographica Section B Structural Science, 2009, 65, 107-125
2105704 CIFC10 H10 N2 S3P 1 21/c 113.06; 9.738; 9.335
90; 105.8; 90
1142.4Day, Graeme M.; Cooper, Timothy G.; Cruz-Cabeza, Aurora J.; Hejczyk, Katarzyna E.; Ammon, Herman L.; Boerrigter, Stephan X. M.; Tan, Jeffrey S.; Della Valle, Raffaele G.; Venuti, Elisabetta; Jose, Jovan; Gadre, Shridhar R.; Desiraju, Gautam R.; Thakur, Tejender S.; van Eijck, Bouke P.; Facelli, Julio C.; Bazterra, Victor E.; Ferraro, Marta B.; Hofmann, Detlef W. M.; Neumann, Marcus A.; Leusen, Frank J. J.; Kendrick, John; Price, Sarah L.; Misquitta, Alston J.; Karamertzanis, Panagiotis G.; Welch, Gareth W. A.; Scheraga, Harold A.; Arnautova, Yelena A.; Schmidt, Martin U.; van de Streek, Jacco; Wolf, Alexandra K.; Schweizer, Bernd
Significant progress in predicting the crystal structures of small organic molecules ‒ a report on the fourth blind test
Acta Crystallographica Section B Structural Science, 2009, 65, 107-125
2105705 CIFC13 H15 N3 O2P 1 21/n 17.2795; 13.6699; 12.6695
90; 96.646; 90
1252.3Day, Graeme M.; Cooper, Timothy G.; Cruz-Cabeza, Aurora J.; Hejczyk, Katarzyna E.; Ammon, Herman L.; Boerrigter, Stephan X. M.; Tan, Jeffrey S.; Della Valle, Raffaele G.; Venuti, Elisabetta; Jose, Jovan; Gadre, Shridhar R.; Desiraju, Gautam R.; Thakur, Tejender S.; van Eijck, Bouke P.; Facelli, Julio C.; Bazterra, Victor E.; Ferraro, Marta B.; Hofmann, Detlef W. M.; Neumann, Marcus A.; Leusen, Frank J. J.; Kendrick, John; Price, Sarah L.; Misquitta, Alston J.; Karamertzanis, Panagiotis G.; Welch, Gareth W. A.; Scheraga, Harold A.; Arnautova, Yelena A.; Schmidt, Martin U.; van de Streek, Jacco; Wolf, Alexandra K.; Schweizer, Bernd
Significant progress in predicting the crystal structures of small organic molecules ‒ a report on the fourth blind test
Acta Crystallographica Section B Structural Science, 2009, 65, 107-125
2105706 CIF
Paper
Br4 SiP a -311.17701; 11.17701; 11.17701
90; 90; 90
1396.29Wolf, Alexandra K.; Glinnemann, Jürgen; Schmidt, Martin U.; Tong, Jianwei; Dinnebier, Robert E.; Simon, Arndt; Köhler, Jürgen
SiBr4‒ prediction and determination of crystal structures
Acta Crystallographica Section B Structural Science, 2009, 65, 342-349
2105707 CIF
Paper
Br4 SiP 1 21/c 110.1319; 6.7002; 10.2389
90; 102.665; 90
678.16Wolf, Alexandra K.; Glinnemann, Jürgen; Schmidt, Martin U.; Tong, Jianwei; Dinnebier, Robert E.; Simon, Arndt; Köhler, Jürgen
SiBr4‒ prediction and determination of crystal structures
Acta Crystallographica Section B Structural Science, 2009, 65, 342-349
2105715 CIFTaP -4 21 m10.201; 10.201; 5.3075
90; 90; 90
552.3Arakcheeva, Alla; Chapuis, Gervais; Birkedal, Henrik; Pattison, Phil; Grinevitch, Vladimir
The commensurate composite σ-structure of β-tantalum
Acta Crystallographica Section B Structural Science, 2003, 59, 324
2105716 CIFTaP -410.1815; 10.1815; 5.295
90; 90; 90
548.9Arakcheeva, Alla; Chapuis, Gervais; Birkedal, Henrik; Pattison, Phil; Grinevitch, Vladimir
The commensurate composite σ-structure of β-tantalum
Acta Crystallographica Section B Structural Science, 2003, 59, 324
2105722 CIF
HKL
Paper
C13 H12 N2 O7P 1 21/c 17.2032; 6.9183; 27.515
90; 92.134; 90
1370.23Lombardo, Giuseppe M.; Rescifina, Antonio; Chiacchio, Ugo; Bacchi, Alessia; Punzo, Francesco
A top‒down approach to crystal engineering of a racemic Δ^2^-isoxazoline
Acta Crystallographica Section B, 2014, 70, 172-180
2105723 CIF
HKL
Paper
C13 H8 Br Co N O5P 1 21/c 17.1962; 10.0563; 18.748
90; 91.548; 90
1356.2Munn, Alexis S.; Clarkson, Guy J.; Walton, Richard I.
Distortions of a flexible metal-organic framework from substituted pendant ligands
Acta Crystallographica Section B, 2014, 70, 11-18
2105724 CIF
Paper
C14 H11 Co N O6P n m a7.1507; 18.1353; 11.6447
90; 90; 90
1510.09Munn, Alexis S.; Clarkson, Guy J.; Walton, Richard I.
Distortions of a flexible metal-organic framework from substituted pendant ligands
Acta Crystallographica Section B, 2014, 70, 11-18
2105725 CIF
Paper
C17 H11.5 Co N O5.25P n m a18.025; 7.184; 11.906
90; 90; 90
1542Munn, Alexis S.; Clarkson, Guy J.; Walton, Richard I.
Distortions of a flexible metal-organic framework from substituted pendant ligands
Acta Crystallographica Section B, 2014, 70, 11-18
2105726 CIF
Paper
C19 H13 Co N O5C 1 2/c 112.9936; 17.9026; 7.1797
90; 116.294; 90
1497.33Munn, Alexis S.; Clarkson, Guy J.; Walton, Richard I.
Distortions of a flexible metal-organic framework from substituted pendant ligands
Acta Crystallographica Section B, 2014, 70, 11-18
2105727 CIF
HKL
Paper
C12 H2 F8 N2P 1 21/n 16.21; 9.7294; 9.2163
90; 98.019; 90
551.4Saccone, Marco; Terraneo, Giancarlo; Pilati, Tullio; Cavallo, Gabriella; Priimagi, Arri; Metrangolo, Pierangelo; Resnati, Giuseppe
Azobenzene-based difunctional halogen-bond donor: towards the engineering of photoresponsive co-crystals
Acta Crystallographica Section B, 2014, 70, 149-156
2105728 CIF
Paper
C14 H6 F8 I2 N2 O SC 1 2/c 121.14; 10.0766; 9.5589
90; 111.347; 90
1896.5Saccone, Marco; Terraneo, Giancarlo; Pilati, Tullio; Cavallo, Gabriella; Priimagi, Arri; Metrangolo, Pierangelo; Resnati, Giuseppe
Azobenzene-based difunctional halogen-bond donor: towards the engineering of photoresponsive co-crystals
Acta Crystallographica Section B, 2014, 70, 149-156
2105729 CIF
Paper
C22 H8 F8 I2 N4P 1 21/c 15.9388; 8.293; 22.16
90; 95.371; 90
1086.6Saccone, Marco; Terraneo, Giancarlo; Pilati, Tullio; Cavallo, Gabriella; Priimagi, Arri; Metrangolo, Pierangelo; Resnati, Giuseppe
Azobenzene-based difunctional halogen-bond donor: towards the engineering of photoresponsive co-crystals
Acta Crystallographica Section B, 2014, 70, 149-156
2105730 CIF
Paper
C40 H26 F8 I2 N4 O2P -15.9758; 13.998; 21.989
80.264; 88.694; 81.381
1792.4Saccone, Marco; Terraneo, Giancarlo; Pilati, Tullio; Cavallo, Gabriella; Priimagi, Arri; Metrangolo, Pierangelo; Resnati, Giuseppe
Azobenzene-based difunctional halogen-bond donor: towards the engineering of photoresponsive co-crystals
Acta Crystallographica Section B, 2014, 70, 149-156
2105731 CIF
HKL
Paper
C14 H15 F3 N2 SP 1 21/c 113.074; 9.185; 12.652
90; 109.33; 90
1433.7Surov, Artem O.; Proshin, Alexey N.; Perlovich, German L.
Crystal structure analysis and sublimation thermodynamics of bicyclo derivatives of a neuroprotector family
Acta Crystallographica Section B, 2014, 70, 47-53
2105732 CIF
Paper
C13 H15 F N2 SP 1 21/c 17.586; 10.088; 16.566
90; 91.41; 90
1267.4Surov, Artem O.; Proshin, Alexey N.; Perlovich, German L.
Crystal structure analysis and sublimation thermodynamics of bicyclo derivatives of a neuroprotector family
Acta Crystallographica Section B, 2014, 70, 47-53
2105733 CIF
Paper
C14 H18 N2 SP b c a8.7377; 14.1088; 20.83
90; 90; 90
2567.89Surov, Artem O.; Proshin, Alexey N.; Perlovich, German L.
Crystal structure analysis and sublimation thermodynamics of bicyclo derivatives of a neuroprotector family
Acta Crystallographica Section B, 2014, 70, 47-53
2105734 CIF
HKL
Paper
C17 H20 O10.25P 1 21/c 111.2247; 8.366; 21.5073
90; 97.265; 90
2003.45Gao, Jiabin; Bhadbhade, Mohan M.; Bishop, Roger
Solvent‒guest control of two extremely similar tetrahydrofuran inclusion structures
Acta Crystallographica Section B, 2014, 70, 126-131
2105735 CIF
Paper
C18 H22 O10.5P 1 21/c 111.4634; 8.5336; 21.6678
90; 99.58; 90
2090.1Gao, Jiabin; Bhadbhade, Mohan M.; Bishop, Roger
Solvent‒guest control of two extremely similar tetrahydrofuran inclusion structures
Acta Crystallographica Section B, 2014, 70, 126-131
2105736 CIF
Paper
C12 H10 B2 O2P 21 21 214.8645; 13.054; 15.508
90; 90; 90
984.78Durka, Krzysztof; Luliński, Sergiusz; Jarzembska, Katarzyna N.; Smetek, Jaromir; Serwatowski, Janusz; Woźniak, Krzysztof
Competition between hydrogen and halogen bonding in the structures of 5,10-dihydroxy-5,10-dihydroboranthrenes
Acta Crystallographica Section B, 2014, 70, 157-171
2105737 CIF
Paper
C12 H8 B2 F2 O2P 1 21/c 117.909; 3.779; 17.355
90; 117.51; 90
1041.7Durka, Krzysztof; Luliński, Sergiusz; Jarzembska, Katarzyna N.; Smetek, Jaromir; Serwatowski, Janusz; Woźniak, Krzysztof
Competition between hydrogen and halogen bonding in the structures of 5,10-dihydroxy-5,10-dihydroboranthrenes
Acta Crystallographica Section B, 2014, 70, 157-171
2105738 CIF
HKL
Paper
C12 H8 B2 Cl2 O2P 1 21/n 17.3645; 3.8696; 20.125
90; 97.543; 90
568.55Durka, Krzysztof; Luliński, Sergiusz; Jarzembska, Katarzyna N.; Smetek, Jaromir; Serwatowski, Janusz; Woźniak, Krzysztof
Competition between hydrogen and halogen bonding in the structures of 5,10-dihydroxy-5,10-dihydroboranthrenes
Acta Crystallographica Section B, 2014, 70, 157-171
2105739 CIF
Paper
C12 H8 B2 Br2 O2P 1 21/n 18.988; 3.905; 16.841
90; 96.11; 90
587.7Durka, Krzysztof; Luliński, Sergiusz; Jarzembska, Katarzyna N.; Smetek, Jaromir; Serwatowski, Janusz; Woźniak, Krzysztof
Competition between hydrogen and halogen bonding in the structures of 5,10-dihydroxy-5,10-dihydroboranthrenes
Acta Crystallographica Section B, 2014, 70, 157-171
2105740 CIF
Paper
C8 H6 B2 O2 S2R -3 :H24.719; 24.719; 4.6681
90; 90; 120
2470.2Durka, Krzysztof; Luliński, Sergiusz; Jarzembska, Katarzyna N.; Smetek, Jaromir; Serwatowski, Janusz; Woźniak, Krzysztof
Competition between hydrogen and halogen bonding in the structures of 5,10-dihydroxy-5,10-dihydroboranthrenes
Acta Crystallographica Section B, 2014, 70, 157-171
2105741 CIF
Paper
C11 H10 Cl2 Li N2 O5P -16.667; 10.495; 11.977
110.773; 99.693; 100.335
745.9Molčanov, Krešimir; Babić, Darko; Kojić-Prodić, Biserka; Stare, Jernej; Maltar-Strmečki, Nadica; Androš, Lidija
Spin-coupling in dimers of 2,3-dicyano-5,6-dichlorosemiquinone radical anions in the crystalline state
Acta Crystallographica Section B, 2014, 70, 181-190
2105742 CIFC8 H4 Cl2 N2 O4 RbP 21 21 26.5088; 18.1788; 9.6194
90; 90; 90
1138.19Molčanov, Krešimir; Babić, Darko; Kojić-Prodić, Biserka; Stare, Jernej; Maltar-Strmečki, Nadica; Androš, Lidija
Spin-coupling in dimers of 2,3-dicyano-5,6-dichlorosemiquinone radical anions in the crystalline state
Acta Crystallographica Section B, 2014, 70, 181-190
2105743 CIFC8 H4 Cl2 N2 O4 RbP 21 21 26.4217; 18.0295; 9.574
90; 90; 90
1108.48Molčanov, Krešimir; Babić, Darko; Kojić-Prodić, Biserka; Stare, Jernej; Maltar-Strmečki, Nadica; Androš, Lidija
Spin-coupling in dimers of 2,3-dicyano-5,6-dichlorosemiquinone radical anions in the crystalline state
Acta Crystallographica Section B, 2014, 70, 181-190
2105744 CIFC8 H4 Cl2 Cs N2 O4P 21 21 26.6462; 18.2212; 9.7758
90; 90; 90
1183.87Molčanov, Krešimir; Babić, Darko; Kojić-Prodić, Biserka; Stare, Jernej; Maltar-Strmečki, Nadica; Androš, Lidija
Spin-coupling in dimers of 2,3-dicyano-5,6-dichlorosemiquinone radical anions in the crystalline state
Acta Crystallographica Section B, 2014, 70, 181-190
2105745 CIF
HKL
C8 H4 Cl2 Cs N2 O4P 21 21 26.5601; 18.152; 9.7345
90; 90; 90
1159.17Molčanov, Krešimir; Babić, Darko; Kojić-Prodić, Biserka; Stare, Jernej; Maltar-Strmečki, Nadica; Androš, Lidija
Spin-coupling in dimers of 2,3-dicyano-5,6-dichlorosemiquinone radical anions in the crystalline state
Acta Crystallographica Section B, 2014, 70, 181-190
2105746 CIF
HKL
Paper
C22 H26 N4 O4P 21 21 217.2598; 10.2744; 27.997
90; 90; 90
2088.3Bisht, Kamal Kumar; Patel, Priyank; Rachuri, Yadagiri; Eringathodi, Suresh
Binary co-crystals of the active pharmaceutical ingredient 1,4-bis(4-pyridyl)-2,3-diaza-1,3-butadiene and camphoric acid
Acta Crystallographica Section B, 2014, 70, 63-71
2105747 CIF
Paper
C56 H62 N12 O8P 1 21 19.9568; 12.914; 20.203
90; 95.734; 90
2584.7Bisht, Kamal Kumar; Patel, Priyank; Rachuri, Yadagiri; Eringathodi, Suresh
Binary co-crystals of the active pharmaceutical ingredient 1,4-bis(4-pyridyl)-2,3-diaza-1,3-butadiene and camphoric acid
Acta Crystallographica Section B, 2014, 70, 63-71
2105748 CIF
Paper
C56 H62 N12 O8P 1 21/n 19.9407; 12.9624; 20.247
90; 95.928; 90
2595Bisht, Kamal Kumar; Patel, Priyank; Rachuri, Yadagiri; Eringathodi, Suresh
Binary co-crystals of the active pharmaceutical ingredient 1,4-bis(4-pyridyl)-2,3-diaza-1,3-butadiene and camphoric acid
Acta Crystallographica Section B, 2014, 70, 63-71
2105749 CIF
HKL
Paper
C7 H5 Cl1.46 F0.54 N OP b c a8.522; 12.291; 14.309
90; 90; 90
1498.78Omondi, Bernard; Lemmerer, Andreas; Fernandes, Manuel A.; Levendis, Demetrius C.; Layh, Marcus
Formation of isostructural solid solutions in 2,6-disubstituted <i>N</i>-phenylformamides and <i>N</i>-phenylthioamides
Acta Crystallographica Section B, 2014, 70, 106-114
2105750 CIFC8.03 H8.1 Cl0.97 N OP b c a8.5073; 13.093; 14.448
90; 90; 90
1609.3Omondi, Bernard; Lemmerer, Andreas; Fernandes, Manuel A.; Levendis, Demetrius C.; Layh, Marcus
Formation of isostructural solid solutions in 2,6-disubstituted <i>N</i>-phenylformamides and <i>N</i>-phenylthioamides
Acta Crystallographica Section B, 2014, 70, 106-114
2105751 CIFC8.78 H10.35 Cl0.22 N SP b c a9.208; 13.142; 14.617
90; 90; 90
1768.83Omondi, Bernard; Lemmerer, Andreas; Fernandes, Manuel A.; Levendis, Demetrius C.; Layh, Marcus
Formation of isostructural solid solutions in 2,6-disubstituted <i>N</i>-phenylformamides and <i>N</i>-phenylthioamides
Acta Crystallographica Section B, 2014, 70, 106-114
2105752 CIFC13 H19 N O0.5 S0.5P 1 21/c 19.022; 9.003; 16.005
90; 103.17; 90
1265.8Omondi, Bernard; Lemmerer, Andreas; Fernandes, Manuel A.; Levendis, Demetrius C.; Layh, Marcus
Formation of isostructural solid solutions in 2,6-disubstituted <i>N</i>-phenylformamides and <i>N</i>-phenylthioamides
Acta Crystallographica Section B, 2014, 70, 106-114
2105753 CIF
Paper
C13 H13 Cl N4 O6 S2P 21 21 217.368; 13.121; 16.247
90; 90; 90
1570.7Sanphui, Palash; Rajput, Lalit
Tuning solubility and stability of hydrochlorothiazide co-crystals
Acta Crystallographica Section B, 2014, 70, 81-90
2105754 CIF
HKL
Paper
C13 H14 Cl N5 O5 S2P 21 21 217.6531; 13.2192; 16.148
90; 90; 90
1633.7Sanphui, Palash; Rajput, Lalit
Tuning solubility and stability of hydrochlorothiazide co-crystals
Acta Crystallographica Section B, 2014, 70, 81-90
2105755 CIF
Paper
C18 H24 Cl2 N8 O10 S4C 1 2/c 117.857; 10.363; 14.548
90; 96.459; 90
2675Sanphui, Palash; Rajput, Lalit
Tuning solubility and stability of hydrochlorothiazide co-crystals
Acta Crystallographica Section B, 2014, 70, 81-90
2105756 CIF
Paper
C21 H22 Cl N5 O8 S2P 1 21/c 112.7042; 10.8626; 18.5745
90; 110.905; 90
2394.6Sanphui, Palash; Rajput, Lalit
Tuning solubility and stability of hydrochlorothiazide co-crystals
Acta Crystallographica Section B, 2014, 70, 81-90
2105757 CIF
Paper
C3 H19 F N O18 P3 U2C 1 2/c 125.8297; 8.756; 17.7432
90; 99.951; 90
3952.5Monteiro, Bernardo; Fernandes, José A.; Pereira, Cláudia C. L.; Vilela, Sérgio M. F.; Tomé, João P. C.; Marçalo, Joaquim; Almeida Paz, Filipe A.
Metal-organic frameworks based on uranyl and phosphonate ligands
Acta Crystallographica Section B, 2014, 70, 28-36
2105758 CIF
Paper
C8 H10 O8 P2 UP 1 21/c 110.9522; 6.4691; 9.2802
90; 96.333; 90
653.5Monteiro, Bernardo; Fernandes, José A.; Pereira, Cláudia C. L.; Vilela, Sérgio M. F.; Tomé, João P. C.; Marçalo, Joaquim; Almeida Paz, Filipe A.
Metal-organic frameworks based on uranyl and phosphonate ligands
Acta Crystallographica Section B, 2014, 70, 28-36
2105759 CIF
HKL
Paper
C9 H28 O20 P3 U1.5P -18.7982; 11.8876; 12.6446
95.219; 106.752; 96.98
1245.89Monteiro, Bernardo; Fernandes, José A.; Pereira, Cláudia C. L.; Vilela, Sérgio M. F.; Tomé, João P. C.; Marçalo, Joaquim; Almeida Paz, Filipe A.
Metal-organic frameworks based on uranyl and phosphonate ligands
Acta Crystallographica Section B, 2014, 70, 28-36
2105760 CIF
HKL
Paper
C26 H38 N2 O10P 1 21/n 110.3947; 17.5546; 47.27
90; 91.321; 90
8623.3Boardman, Nicole D.; Munshi, Tasnim; Scowen, Ian J.; Seaton, Colin C.
Creation of a ternary complex between a crown ether, 4-aminobenzoic acid and 3,5-dinitrobenzoic acid
Acta Crystallographica Section B, 2014, 70, 132-140
2105761 CIFC33 H39 N5 O20P -17.6055; 16.0157; 16.4476
73.156; 85.54; 89.562
1911.45Boardman, Nicole D.; Munshi, Tasnim; Scowen, Ian J.; Seaton, Colin C.
Creation of a ternary complex between a crown ether, 4-aminobenzoic acid and 3,5-dinitrobenzoic acid
Acta Crystallographica Section B, 2014, 70, 132-140
2105762 CIF
Paper
C34 H36 N6 Ni O8 S2P 1 21 111.8719; 14.1629; 21.9663
90; 95.342; 90
3677.4Soliman, Saied M.; Elzawy, Zahia B.; Abu-Youssef, Morsy A. M.; Albering, Jörg; Gatterer, Karl; Öhrström, Lars; Kettle, Sidney F. A.
Towards the chemical control of molecular packing: syntheses and crystal structures of three <i>trans</i>-[Ni<i>L</i>~4~(NCS)~2~] complexes
Acta Crystallographica Section B, 2014, 70, 115-125
2105763 CIF
Paper
C30 H28 N6 Ni O8 S2P 1 21/n 111.8991; 51.4066; 14.1366
90; 99.498; 90
8528.7Soliman, Saied M.; Elzawy, Zahia B.; Abu-Youssef, Morsy A. M.; Albering, Jörg; Gatterer, Karl; Öhrström, Lars; Kettle, Sidney F. A.
Towards the chemical control of molecular packing: syntheses and crystal structures of three <i>trans</i>-[Ni<i>L</i>~4~(NCS)~2~] complexes
Acta Crystallographica Section B, 2014, 70, 115-125
2105764 CIF
HKL
Paper
C50 H36 N6 Ni O4 S2P 1 21/c 18.9345; 20.8306; 11.1406
90; 90.66; 90
2073.25Soliman, Saied M.; Elzawy, Zahia B.; Abu-Youssef, Morsy A. M.; Albering, Jörg; Gatterer, Karl; Öhrström, Lars; Kettle, Sidney F. A.
Towards the chemical control of molecular packing: syntheses and crystal structures of three <i>trans</i>-[Ni<i>L</i>~4~(NCS)~2~] complexes
Acta Crystallographica Section B, 2014, 70, 115-125
2105765 CIF
Paper
C86 H96 Ag22 F48 O44 S12C 1 2/c 122.076; 14.793; 45.863
90; 93.501; 90
14950Hau, Sam C. K.; Tam, Dennis Y. S.; Mak, Thomas C. W.
Organosilver(I) framework assembly with trifluoroacetate and enediyne-functionalized alicycles
Acta Crystallographica Section B, 2014, 70, 37-46
2105766 CIF
Paper
C89 H102 Ag22 F48 O44 S12C 1 2/c 121.9927; 14.8488; 45.797
90; 93.937; 90
14920.4Hau, Sam C. K.; Tam, Dennis Y. S.; Mak, Thomas C. W.
Organosilver(I) framework assembly with trifluoroacetate and enediyne-functionalized alicycles
Acta Crystallographica Section B, 2014, 70, 37-46
2105767 CIF
HKL
Paper
C32 H42 Ag7 F15 O15 S5C 1 c 117.8567; 21.007; 16.044
90; 117.802; 90
5323.6Hau, Sam C. K.; Tam, Dennis Y. S.; Mak, Thomas C. W.
Organosilver(I) framework assembly with trifluoroacetate and enediyne-functionalized alicycles
Acta Crystallographica Section B, 2014, 70, 37-46
2105768 CIF
Paper
C31 H38 Ag7 F15 O14 S4P 113.435; 13.8806; 16.3609
110.194; 106.492; 104.003
2542.2Hau, Sam C. K.; Tam, Dennis Y. S.; Mak, Thomas C. W.
Organosilver(I) framework assembly with trifluoroacetate and enediyne-functionalized alicycles
Acta Crystallographica Section B, 2014, 70, 37-46
2105769 CIF
Paper
C20 H12 Ag7 F15 O12C 1 2/c 123.394; 13.9512; 10.792
90; 102.214; 90
3442.5Hau, Sam C. K.; Tam, Dennis Y. S.; Mak, Thomas C. W.
Organosilver(I) framework assembly with trifluoroacetate and enediyne-functionalized alicycles
Acta Crystallographica Section B, 2014, 70, 37-46
2105770 CIF
Paper
C43 H25 Ag9 F27 N3 O18P 1 21 18.9453; 24.902; 14.4248
90; 105.016; 90
3103.5Hau, Sam C. K.; Tam, Dennis Y. S.; Mak, Thomas C. W.
Organosilver(I) framework assembly with trifluoroacetate and enediyne-functionalized alicycles
Acta Crystallographica Section B, 2014, 70, 37-46
2105771 CIF
Paper
C40 H24 Ag7 F15 N4 O10P -112.427; 14.132; 16.384
96.481; 108.935; 115.229
2353.5Hau, Sam C. K.; Tam, Dennis Y. S.; Mak, Thomas C. W.
Organosilver(I) framework assembly with trifluoroacetate and enediyne-functionalized alicycles
Acta Crystallographica Section B, 2014, 70, 37-46
2105772 CIF
Paper
C26 H9 Ag11 Br2 F27 N O21P b c a16.861; 24.431; 26.723
90; 90; 90
11008Hau, Sam C. K.; Tam, Dennis Y. S.; Mak, Thomas C. W.
Organosilver(I) framework assembly with trifluoroacetate and enediyne-functionalized alicycles
Acta Crystallographica Section B, 2014, 70, 37-46
2105773 CIF
HKL
Paper
C7 H17 Eu O11P -18.0917; 8.868; 10.115
86.994; 73.002; 68.172
643.1Cañadillas-Delgado, Laura; Fabelo, Óscar; Pasán, Jorge; Déniz, Mariadel; Martínez-Benito, Carla; Díaz-Gallifa, Pau; Martín, Tomás; Ruiz-Pérez, Catalina
Three new europium(III) methanetriacetate metal-organic frameworks: the influence of synthesis on the product topology
Acta Crystallographica Section B, 2014, 70, 19-27
2105774 CIF
HKL
Paper
C7 H11 Eu O8P c a 2117.4543; 7.8087; 14.9761
90; 90; 90
2041.2Cañadillas-Delgado, Laura; Fabelo, Óscar; Pasán, Jorge; Déniz, Mariadel; Martínez-Benito, Carla; Díaz-Gallifa, Pau; Martín, Tomás; Ruiz-Pérez, Catalina
Three new europium(III) methanetriacetate metal-organic frameworks: the influence of synthesis on the product topology
Acta Crystallographica Section B, 2014, 70, 19-27
2105775 CIF
Paper
C7 H11 Eu O8P b c n14.1085; 7.7825; 18.0083
90; 90; 90
1977.3Cañadillas-Delgado, Laura; Fabelo, Óscar; Pasán, Jorge; Déniz, Mariadel; Martínez-Benito, Carla; Díaz-Gallifa, Pau; Martín, Tomás; Ruiz-Pérez, Catalina
Three new europium(III) methanetriacetate metal-organic frameworks: the influence of synthesis on the product topology
Acta Crystallographica Section B, 2014, 70, 19-27
2105776 CIF
Paper
C12 H8 I2 N2 S6P b c a14.607; 12.0315; 20.9654
90; 90; 90
3684.55Lieffrig, Julien; Jeannin, Olivier; Vacher, Antoine; Lorcy, Dominique; Auban-Senzier, Pascale; Fourmigué, Marc
C—I···NC halogen bonding in two polymorphs of the mixed-valence 2:1 charge-transfer salt (EDT-TTF-I~2~)~2~(TCNQF~4~), with segregated <i>versus</i> alternated stacks
Acta Crystallographica Section B, 2014, 70, 141-148
2105777 CIF
Paper
C8 H4 I2 S6P n m a17.3371; 12.6274; 6.3276
90; 90; 90
1385.25Lieffrig, Julien; Jeannin, Olivier; Vacher, Antoine; Lorcy, Dominique; Auban-Senzier, Pascale; Fourmigué, Marc
C—I···NC halogen bonding in two polymorphs of the mixed-valence 2:1 charge-transfer salt (EDT-TTF-I~2~)~2~(TCNQF~4~), with segregated <i>versus</i> alternated stacks
Acta Crystallographica Section B, 2014, 70, 141-148
2105778 CIF
HKL
Paper
C28 H8 F4 I4 N4 S12P -14.8311; 12.0457; 16.6577
91.128; 92.95; 94.213
965.21Lieffrig, Julien; Jeannin, Olivier; Vacher, Antoine; Lorcy, Dominique; Auban-Senzier, Pascale; Fourmigué, Marc
C—I···NC halogen bonding in two polymorphs of the mixed-valence 2:1 charge-transfer salt (EDT-TTF-I~2~)~2~(TCNQF~4~), with segregated <i>versus</i> alternated stacks
Acta Crystallographica Section B, 2014, 70, 141-148
2105779 CIF
HKL
Paper
C28 H8 F4 I4 N4 S12P -111.003; 12.7689; 14.9201
104.906; 106.449; 95.863
1907.83Lieffrig, Julien; Jeannin, Olivier; Vacher, Antoine; Lorcy, Dominique; Auban-Senzier, Pascale; Fourmigué, Marc
C—I···NC halogen bonding in two polymorphs of the mixed-valence 2:1 charge-transfer salt (EDT-TTF-I~2~)~2~(TCNQF~4~), with segregated <i>versus</i> alternated stacks
Acta Crystallographica Section B, 2014, 70, 141-148
2105780 CIF
HKL
Paper
C15 H17 N5 O4P -18.4853; 13.424; 14.8856
111.725; 92.8464; 93.5278
1567.35Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105781 CIF
HKL
C15 H17 N5 O4P n a 2114.53798; 11.0793; 10.02456
90; 90; 90
1614.66Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105782 CIF
HKL
C36 H39 Cl N10 O8P -112.439; 13.1409; 13.2251
69.439; 80.418; 63.557
1812.17Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105783 CIF
HKL
C36 H39 Br N10 O8P -112.569; 13.409; 13.269
68.991; 80.215; 64.007
1876.3Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105784 CIF
HKL
C37 H42 N10 O8P -112.475; 13.488; 13.316
68.318; 79.948; 64.124
1873Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105785 CIF
HKL
C22 H25 N5 O4P -16.7113; 13.5803; 23.579
87.1; 88.572; 86.065
2140.7Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105786 CIF
HKL
C23 H27 N5 O4P 1 21/n 113.8492; 6.789; 23.396
90; 92.26; 90
2198.03Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105787 CIF
HKL
C27 H32 N5 O4P -16.8474; 13.431; 14.44
77.009; 86.596; 88.687
1291.7Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105788 CIF
HKL
C15 H19 N5 O5P 1 21/c 110.2641; 26.9469; 11.9845
90; 103.547; 90
3222.52Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105789 CIF
HKL
C14 H15 N5 O4P 1 21/c 16.5769; 21.905; 11.0496
90; 112.912; 90
1466.3Madusanka, Nadeesh; Eddleston, Mark D.; Arhangelskis, Mihails; Jones, William
Polymorphs, hydrates and solvates of a co-crystal of caffeine with anthranilic acid
Acta Crystallographica Section B, 2014, 70, 72-80
2105792 CIF
HKL
Paper
H9 K9 O33 S8P 1 21/c 17.0685; 19.792; 23.4724
90; 95.372; 90
3269.4Makarova, Irina; Grebenev, Vadim; Dmitricheva, Elena; Dolbinina, Valentina; Chernyshov, Dmitry
<i>M~m~</i>H~<i>n~</i>(<i>X</i>O~4~)~(<i>m~+{ıt n</i>)/2} crystals: structure, phase transitions, hydrogen bonds, conductivity. I. K~9~H~7~(SO~4~)~8~·H~2~O crystals ‒ a new representative of the family of solid acid conductors
Acta Crystallographica Section B, 2014, 70, 218-226
2105793 CIF
HKL
Paper
H7 K9 O32 S8P c a n7.1474; 19.7761; 23.2542
90; 90; 90
3286.93Makarova, Irina; Grebenev, Vadim; Dmitricheva, Elena; Dolbinina, Valentina; Chernyshov, Dmitry
<i>M~m~</i>H~<i>n~</i>(<i>X</i>O~4~)~(<i>m~+{ıt n</i>)/2} crystals: structure, phase transitions, hydrogen bonds, conductivity. I. K~9~H~7~(SO~4~)~8~·H~2~O crystals ‒ a new representative of the family of solid acid conductors
Acta Crystallographica Section B, 2014, 70, 218-226
2105794 CIF
HKL
Paper
Ba2 Ca0.07 Cu3 O6.85 Y0.93P m m m3.8114; 3.8712; 11.6824
90; 90; 90
172.37Bertolotti, Federica; Calore, Leandro; Gervasio, Giuliana; Agostino, Angelo; Truccato, Marco; Operti, Lorenza
X-ray crystal structures of Al-doped (Y,Ca)Ba~2~Cu~3~O~7{-~<i>y</i>} whiskers
Acta Crystallographica Section B, 2014, 70, 236-242
2105795 CIF
HKL
Al0.06 Ba2 Ca0.06 Cu2.94 O6.81 Y0.94P m m m3.838; 3.8735; 11.6947
90; 90; 90
173.859Bertolotti, Federica; Calore, Leandro; Gervasio, Giuliana; Agostino, Angelo; Truccato, Marco; Operti, Lorenza
X-ray crystal structures of Al-doped (Y,Ca)Ba~2~Cu~3~O~7{-~<i>y</i>} whiskers
Acta Crystallographica Section B, 2014, 70, 236-242
2105796 CIF
HKL
Al0.3 Ba1.92 Ca0.2 Cu2.7 O6.76 Y0.88P 4/m m m3.8595; 3.8595; 11.6456
90; 90; 90
173.47Bertolotti, Federica; Calore, Leandro; Gervasio, Giuliana; Agostino, Angelo; Truccato, Marco; Operti, Lorenza
X-ray crystal structures of Al-doped (Y,Ca)Ba~2~Cu~3~O~7{-~<i>y</i>} whiskers
Acta Crystallographica Section B, 2014, 70, 236-242
2105797 CIF
HKL
Paper
C6 H7 N3 OP 21 21 213.7601; 11.2911; 14.6877
90; 90; 90
623.58Rajalakshmi, Gnanasekaran; Hathwar, Venkatesha R.; Kumaradhas, Poomani
Topological analysis of electron density and the electrostatic properties of isoniazid: an experimental and theoretical study
Acta Crystallographica Section B, 2014, 70, 331-341
2105798 CIF
HKL
Paper
K La S2R -3 m :H4.2651; 4.2651; 21.929
90; 90; 120
345.47Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel
Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series
Acta Crystallographica Section B, 2014, 70, 360-371
2105799 CIF
HKL
Paper
K Pr S2R -3 m :H4.1925; 4.1925; 21.892
90; 90; 120
333.24Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel
Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series
Acta Crystallographica Section B, 2014, 70, 360-371
2105800 CIF
HKL
Paper
Eu K S2R -3 m :H4.0981; 4.0981; 21.8212
90; 90; 120
317.38Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel
Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series
Acta Crystallographica Section B, 2014, 70, 360-371
2105801 CIF
HKL
Paper
Gd K S2R -3 m :H4.0715; 4.0715; 21.901
90; 90; 120
314.42Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel
Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series
Acta Crystallographica Section B, 2014, 70, 360-371
2105802 CIF
HKL
Paper
K Lu S2R -3 m :H3.949; 3.949; 21.871
90; 90; 120
295.37Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel
Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series
Acta Crystallographica Section B, 2014, 70, 360-371
2105803 CIF
HKL
Paper
K S2 YR -3 m :H4.0216; 4.0216; 21.884
90; 90; 120
306.52Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel
Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series
Acta Crystallographica Section B, 2014, 70, 360-371
2105804 CIF
HKL
Paper
Rb S2 YR -3 m :H4.0444; 4.0444; 22.8267
90; 90; 120
323.36Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel
Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series
Acta Crystallographica Section B, 2014, 70, 360-371
2105805 CIF
HKL
Paper
La Na S2F m -3 m5.8766; 5.8766; 5.8766
90; 90; 90
202.95Fábry, Jan; Havlák, Lubomír; Dušek, Michal; Vaněk, Přemysl; Drahokoupil, Jan; Jurek, Karel
Structure determination of KLaS~2~, KPrS~2~, KEuS~2~, KGdS~2~, KLuS~2~, KYS~2~, RbYS~2~, NaLaS~2~ and crystal-chemical analysis of the group 1 and thallium(I) rare-earth sulfide series
Acta Crystallographica Section B, 2014, 70, 360-371

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