Crystallography Open Database

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2104197 CIF
Paper
C15 H12 Cl N5 OP 1 21/n 17.5716; 16.6432; 10.945
90; 93.549; 90
1376.6Cobo, Justo; Trilleras, Jorge; Quiroga, Jairo; Marchal, Antonio; Nogueras, Manuel; Low, John N.; Glidewell, Christopher
<i>N</i>^6^-Substituted 2-amino-4-chloro-5-formylpyrimidines: puckered <i>versus</i> planar pyrimidine rings, and hydrogen-bonded aggregation in zero, one, two and three dimensions
Acta Crystallographica Section B, 2008, 64, 596-609
2104198 CIF
Paper
C11 H16 Cl N5 O2P -17.2147; 8.8563; 10.2855
84.856; 85.296; 79.092
641.3Cobo, Justo; Trilleras, Jorge; Quiroga, Jairo; Marchal, Antonio; Nogueras, Manuel; Low, John N.; Glidewell, Christopher
<i>N</i>^6^-Substituted 2-amino-4-chloro-5-formylpyrimidines: puckered <i>versus</i> planar pyrimidine rings, and hydrogen-bonded aggregation in zero, one, two and three dimensions
Acta Crystallographica Section B, 2008, 64, 596-609
2104199 CIF
Paper
C10 H13 Cl N4 OC 1 c 114.4681; 11.1378; 7.4534
90; 116.535; 90
1074.5Cobo, Justo; Trilleras, Jorge; Quiroga, Jairo; Marchal, Antonio; Nogueras, Manuel; Low, John N.; Glidewell, Christopher
<i>N</i>^6^-Substituted 2-amino-4-chloro-5-formylpyrimidines: puckered <i>versus</i> planar pyrimidine rings, and hydrogen-bonded aggregation in zero, one, two and three dimensions
Acta Crystallographica Section B, 2008, 64, 596-609
2104200 CIF
HKL
Paper
C9 H30 Cl9 P3 Sb2P n a 2114.842; 9.3475; 21.624
90; 90; 90
3000Gagor, Anna; Wojtaś, Maciej; Pietraszko, Adam; Jakubas, Ryszard
From six- to five-coordinated Sb^III^ in [(CH~3~)~3~PH]~3~[Sb~2~Cl~9~]: transition pathways from single-crystal X-ray diffraction
Acta Crystallographica Section B, 2008, 64, 558-566
2104201 CIF
Paper
C9 H30 Cl9 P3 Sb2P n a m15.07; 9.3026; 22.008
90; 90; 90
3085.3Gagor, Anna; Wojtaś, Maciej; Pietraszko, Adam; Jakubas, Ryszard
From six- to five-coordinated Sb^III^ in [(CH~3~)~3~PH]~3~[Sb~2~Cl~9~]: transition pathways from single-crystal X-ray diffraction
Acta Crystallographica Section B, 2008, 64, 558-566
2104202 CIF
HKL
Paper
C18 H60 Cl18 P6 Sb4P 63/m m c9.191; 9.191; 22.011
90; 90; 120
1610.3Gagor, Anna; Wojtaś, Maciej; Pietraszko, Adam; Jakubas, Ryszard
From six- to five-coordinated Sb^III^ in [(CH~3~)~3~PH]~3~[Sb~2~Cl~9~]: transition pathways from single-crystal X-ray diffraction
Acta Crystallographica Section B, 2008, 64, 558-566
2104203 CIF
HKL
Paper
F5 H8 N2 Nb OC m c 215.9915; 14.4518; 7.1999
90; 90; 90
623.42Udovenko, Anatoly A.; Laptash, Natalia M.
Orientational disorder and phase transitions in crystals of (NH~4~)~2~NbOF~5~
Acta Crystallographica Section B, 2008, 64, 527-533
2104204 CIF
HKL
Paper
F5 H8 N2 Nb OC 1 2 114.4051; 5.9715; 7.2312
90; 90.195; 90
622.02Udovenko, Anatoly A.; Laptash, Natalia M.
Orientational disorder and phase transitions in crystals of (NH~4~)~2~NbOF~5~
Acta Crystallographica Section B, 2008, 64, 527-533
2104205 CIF
HKL
Paper
F5 H8 N2 Nb OI 1 a 114.3384; 5.9804; 14.4524
90; 90.11; 90
1239.3Udovenko, Anatoly A.; Laptash, Natalia M.
Orientational disorder and phase transitions in crystals of (NH~4~)~2~NbOF~5~
Acta Crystallographica Section B, 2008, 64, 527-533
2104206 CIF
HKL
Paper
C25 H23 Cl P RhP -110.243; 10.4042; 11.4078
99.213; 103.131; 115.08
1026.01Sparkes, Hazel A.; Brayshaw, Simon K.; Weller, Andrew S.; Howard, Judith A. K.
[Rh(C~7~H~8~)(PPh~3~)Cl]: an experimental charge-density study
Acta Crystallographica Section B, 2008, 64, 550-557
2104207 CIF
Paper
C5 H8 N4 O4P 1 21/c 17.8857; 6.962; 14.4283
90; 98.027; 90
784.36Gryl, Marlena; Krawczuk, Anna; Stadnicka, Katarzyna
Polymorphism of urea‒barbituric acid co-crystals
Acta Crystallographica Section B, 2008, 64, 623-632
2104208 CIF
Paper
C5 H8 N4 O4C 1 c 115.9423; 5.0984; 10.5534
90; 110.57; 90
803.09Gryl, Marlena; Krawczuk, Anna; Stadnicka, Katarzyna
Polymorphism of urea‒barbituric acid co-crystals
Acta Crystallographica Section B, 2008, 64, 623-632
2104209 CIF
Paper
C5 H8 N4 O4P -18.1588; 9.1117; 10.9268
100.248; 91.515; 99.192
787.82Gryl, Marlena; Krawczuk, Anna; Stadnicka, Katarzyna
Polymorphism of urea‒barbituric acid co-crystals
Acta Crystallographica Section B, 2008, 64, 623-632
2104210 CIF
HKL
Paper
Ga2 O9 Zn6C m c m3.2465; 19.64; 24.783
90; 90; 90
1580.2Michiue, Yuichi; Kimizuka, Noboru; Kanke, Yasushi
Structure of Ga~2~O~3~(ZnO)~6~: a member of the homologous series Ga~2~O~3~(ZnO)~<i>m~</i>
Acta Crystallographica Section B, 2008, 64, 521-526
2104211 CIF
HKL
Paper
C4 D4 SP 1 21 111.05278; 7.50396; 10.1632
90; 89.996; 90
842.93Damay, F.; Rodríguez-Carvajal, J.; André, D.; Dunstetter, F.; Szwarc, H.
Orientational ordering in the low-temperature stable phases of deuterated thiophene
Acta Crystallographica Section B, 2008, 64, 589-595
2104212 CIF
Paper
C4 D4 SP 1 21 111.02171; 7.42951; 10.09755
90; 89.989; 90
826.85Damay, F.; Rodríguez-Carvajal, J.; André, D.; Dunstetter, F.; Szwarc, H.
Orientational ordering in the low-temperature stable phases of deuterated thiophene
Acta Crystallographica Section B, 2008, 64, 589-595
2104213 CIF
HKL
Paper
C4.572 D4.572 S1.143P b n m5.5226; 7.62; 10.2688
90; 90; 90
432.134Damay, F.; Rodríguez-Carvajal, J.; André, D.; Dunstetter, F.; Szwarc, H.
Orientational ordering in the low-temperature stable phases of deuterated thiophene
Acta Crystallographica Section B, 2008, 64, 589-595
2104214 CIF
Paper
C4 D4 SP21(\a0\g)05.5169; 7.5335; 10.1817
90; 89.996; 90
423.167Damay, F.; Rodríguez-Carvajal, J.; André, D.; Dunstetter, F.; Szwarc, H.
Orientational ordering in the low-temperature stable phases of deuterated thiophene
Acta Crystallographica Section B, 2008, 64, 589-595
2104215 CIF
HKL
Paper
B6 CeP m -3 m4.14288; 4.14288; 4.14288
90; 90; 90
71.1061Makita, Ryoko; Tanaka, Kiyoaki; Ōnuki, Yoshichika
5<i>d</i> and 4<i>f</i> electron configuration of CeB~6~ at 340 and 535K
Acta Crystallographica Section B, 2008, 64, 534-549
2104216 CIF
HKL
Paper
B6 CeP m -3 m4.14918; 4.14918; 4.14918
90; 90; 90
71.431Makita, Ryoko; Tanaka, Kiyoaki; Ōnuki, Yoshichika
5<i>d</i> and 4<i>f</i> electron configuration of CeB~6~ at 340 and 535K
Acta Crystallographica Section B, 2008, 64, 534-549
2104217 CIF
Paper
C7 H14 I N5 S2C m c m15.18; 11.827; 8.375
90; 90; 90
1503.6Małuszyńska, H.; Czarnecki, P.; Fojud, Z.; Wasicki, J.
Redetermination of the structure and dielectric properties of bis(thiourea) pyridinium iodide ‒ a new ferroelectric inclusion compound
Acta Crystallographica Section B, 2008, 64, 567-572
2104218 CIF
Paper
C7 H14 I N5 S2C 2 c m15.022; 11.227; 8.341
90; 90; 90
1406.7Małuszyńska, H.; Czarnecki, P.; Fojud, Z.; Wasicki, J.
Redetermination of the structure and dielectric properties of bis(thiourea) pyridinium iodide ‒ a new ferroelectric inclusion compound
Acta Crystallographica Section B, 2008, 64, 567-572
2104219 CIF
Paper
C7 H14 I N5 S2P 21 c n14.86; 11.291; 8.307
90; 90; 90
1393.8Małuszyńska, H.; Czarnecki, P.; Fojud, Z.; Wasicki, J.
Redetermination of the structure and dielectric properties of bis(thiourea) pyridinium iodide ‒ a new ferroelectric inclusion compound
Acta Crystallographica Section B, 2008, 64, 567-572
2104220 CIF
Paper
C6 H12 OP 1 21/c 15.7877; 20.267; 15.971
90; 98.289; 90
1853.8Ibberson, Richard M.; Parsons, Simon; Allan, David R.; Bell, Anthony M. T.
Polymorphism in cyclohexanol
Acta Crystallographica Section B, 2008, 64, 573-582
2104221 CIF
Paper
C6 D12 OP -4 21 c10.53507; 10.535067; 10.53715
90; 90; 90
1169.49Ibberson, Richard M.; Parsons, Simon; Allan, David R.; Bell, Anthony M. T.
Polymorphism in cyclohexanol
Acta Crystallographica Section B, 2008, 64, 573-582
2104222 CIF
Paper
C6 D12 OP 1 c 112.0244; 6.362; 8.10998
90; 107.733; 90
590.93Ibberson, Richard M.; Parsons, Simon; Allan, David R.; Bell, Anthony M. T.
Polymorphism in cyclohexanol
Acta Crystallographica Section B, 2008, 64, 573-582
2104223 CIF
Paper
F4 N2 O2 WC m c m5.941; 14.4206; 7.1456
90; 90; 90
612.18Udovenko, Anatoly A.; Laptash, Natalia M.
Disorder in crystals of dioxofluorotungstates, (NH~4~)~2~WO~2~F~4~ and Rb~2~WO~2~F~4~
Acta Crystallographica Section B, 2008, 64, 645-651
2104224 CIF
Paper
F4 N2 O2 WP -15.9013; 14.1993; 7.7162
90.022; 112.466; 89.999
597.5Udovenko, Anatoly A.; Laptash, Natalia M.
Disorder in crystals of dioxofluorotungstates, (NH~4~)~2~WO~2~F~4~ and Rb~2~WO~2~F~4~
Acta Crystallographica Section B, 2008, 64, 645-651
2104225 CIF
Paper
F4 O2 Rb2 WP -3 m 16.0056; 6.0056; 4.8636
90; 90; 120
151.915Udovenko, Anatoly A.; Laptash, Natalia M.
Disorder in crystals of dioxofluorotungstates, (NH~4~)~2~WO~2~F~4~ and Rb~2~WO~2~F~4~
Acta Crystallographica Section B, 2008, 64, 645-651
2104226 CIF
Paper
Co2 O4 SiP n m a10.3005; 6.0028; 4.7816
90; 90; 90
295.655Sazonov, Andrew; Meven, Martin; Hutanu, Vladimir; Kaiser, Volker; Heger, Gernot; Trots, Dmytro; Merz, Michael
Structural behaviour of synthetic Co~2~SiO~4~ at low temperatures
Acta Crystallographica Section B, 2008, 64, 661-668
2104227 CIF
Paper
Co2 O4 SiP n m a10.2869; 5.9889; 4.7781
90; 90; 90
294.365Sazonov, Andrew; Meven, Martin; Hutanu, Vladimir; Kaiser, Volker; Heger, Gernot; Trots, Dmytro; Merz, Michael
Structural behaviour of synthetic Co~2~SiO~4~ at low temperatures
Acta Crystallographica Section B, 2008, 64, 661-668
2104228 CIF
Paper
Co2 O4 SiP n m a10.2864; 5.9872; 4.7785
90; 90; 90
294.292Sazonov, Andrew; Meven, Martin; Hutanu, Vladimir; Kaiser, Volker; Heger, Gernot; Trots, Dmytro; Merz, Michael
Structural behaviour of synthetic Co~2~SiO~4~ at low temperatures
Acta Crystallographica Section B, 2008, 64, 661-668
2104229 CIF
Paper
C11 H14 N4 O2 SP 1 21/c 110.9886; 12.6952; 9.6299
90; 104.535; 90
1300.4Kalinowska-Tłuścik, Justyna; Jarzembek, Krystyna; Śliwiński, Jan; Oleksyn, Barbara J.; Kozik, Violetta; Polański, Jarosław
Bitter sweeteners: tetrazole derivatives of arylsulfonylalcanoids ‒ synthesis, structure and comparative study
Acta Crystallographica Section B, 2008, 64, 760-770
2104230 CIF
Paper
C9 H9 Cl N4 O2 SP 1 21/n 19.7121; 19.1953; 13.4438
90; 108.737; 90
2373.46Kalinowska-Tłuścik, Justyna; Jarzembek, Krystyna; Śliwiński, Jan; Oleksyn, Barbara J.; Kozik, Violetta; Polański, Jarosław
Bitter sweeteners: tetrazole derivatives of arylsulfonylalcanoids ‒ synthesis, structure and comparative study
Acta Crystallographica Section B, 2008, 64, 760-770
2104231 CIF
Paper
C11 H14 N4 O3 SP 1 21/c 19.8188; 12.5801; 21.5687
90; 99.339; 90
2628.89Kalinowska-Tłuścik, Justyna; Jarzembek, Krystyna; Śliwiński, Jan; Oleksyn, Barbara J.; Kozik, Violetta; Polański, Jarosław
Bitter sweeteners: tetrazole derivatives of arylsulfonylalcanoids ‒ synthesis, structure and comparative study
Acta Crystallographica Section B, 2008, 64, 760-770
2104232 CIF
Paper
C8 H8 N4 O2 SC 1 c 122.8887; 5.0315; 9.1377
90; 105.387; 90
1014.62Kalinowska-Tłuścik, Justyna; Jarzembek, Krystyna; Śliwiński, Jan; Oleksyn, Barbara J.; Kozik, Violetta; Polański, Jarosław
Bitter sweeteners: tetrazole derivatives of arylsulfonylalcanoids ‒ synthesis, structure and comparative study
Acta Crystallographica Section B, 2008, 64, 760-770
2104233 CIF
Paper
C9 H8 Cl N O2 SP 1 21/n 17.077; 15.5895; 9.3409
90; 98.114; 90
1020.24Kalinowska-Tłuścik, Justyna; Jarzembek, Krystyna; Śliwiński, Jan; Oleksyn, Barbara J.; Kozik, Violetta; Polański, Jarosław
Bitter sweeteners: tetrazole derivatives of arylsulfonylalcanoids ‒ synthesis, structure and comparative study
Acta Crystallographica Section B, 2008, 64, 760-770
2104234 CIF
HKL
Paper
C10 H36 N2 Ni O19P 1 21/c 111.95; 12.686; 15.988
90; 101.51; 90
2375Siegler, Maxime A.; Parkin, Sean; Selegue, John P.; Brock, Carolyn Pratt
The elusive [Ni(H~2~O)~2~(15-crown-5)]^2+^ cation and related co-crystals of nickel(II) hydrates and 15-crown-5
Acta Crystallographica Section B, 2008, 64, 725-737
2104235 CIF
HKL
Paper
C10 H34 N2 Ni O18B 1 21 116.176; 16.514; 17.876
90; 106.42; 90
4580.5Siegler, Maxime A.; Parkin, Sean; Selegue, John P.; Brock, Carolyn Pratt
The elusive [Ni(H~2~O)~2~(15-crown-5)]^2+^ cation and related co-crystals of nickel(II) hydrates and 15-crown-5
Acta Crystallographica Section B, 2008, 64, 725-737
2104236 CIF
HKL
Paper
C10 H34 N2 Ni O18P -116.036; 24.765; 10.163
89.71; 122.53; 83.58
3371.2Siegler, Maxime A.; Parkin, Sean; Selegue, John P.; Brock, Carolyn Pratt
The elusive [Ni(H~2~O)~2~(15-crown-5)]^2+^ cation and related co-crystals of nickel(II) hydrates and 15-crown-5
Acta Crystallographica Section B, 2008, 64, 725-737
2104237 CIF
HKL
Paper
C22 H68 N4 Ni2 O34P 1 21/n 116.241; 15.481; 10.429
90; 120.75; 90
2253.5Siegler, Maxime A.; Parkin, Sean; Selegue, John P.; Brock, Carolyn Pratt
The elusive [Ni(H~2~O)~2~(15-crown-5)]^2+^ cation and related co-crystals of nickel(II) hydrates and 15-crown-5
Acta Crystallographica Section B, 2008, 64, 725-737
2104238 CIF
HKL
Paper
C20 H56 N4 Ni2 O30P b c a15.352; 16.278; 30.716
90; 90; 90
7675.9Siegler, Maxime A.; Parkin, Sean; Selegue, John P.; Brock, Carolyn Pratt
The elusive [Ni(H~2~O)~2~(15-crown-5)]^2+^ cation and related co-crystals of nickel(II) hydrates and 15-crown-5
Acta Crystallographica Section B, 2008, 64, 725-737
2104239 CIF
HKL
Paper
C14 H30 N4 Ni O13P -112.144; 12.137; 16.039
90.12; 105.47; 90.04
2278.4Siegler, Maxime A.; Parkin, Sean; Selegue, John P.; Brock, Carolyn Pratt
The elusive [Ni(H~2~O)~2~(15-crown-5)]^2+^ cation and related co-crystals of nickel(II) hydrates and 15-crown-5
Acta Crystallographica Section B, 2008, 64, 725-737
2104240 CIF
HKL
Paper
C10 H24 N2 Ni O13P 1 21/c 114.676; 13.961; 25.552
90; 96.56; 90
5201.1Siegler, Maxime A.; Parkin, Sean; Selegue, John P.; Brock, Carolyn Pratt
The elusive [Ni(H~2~O)~2~(15-crown-5)]^2+^ cation and related co-crystals of nickel(II) hydrates and 15-crown-5
Acta Crystallographica Section B, 2008, 64, 725-737
2104241 CIF
HKL
Paper
C10 H24 Fe N2 O13B 1 21 114.507; 14.226; 68.39
90; 96.23; 90
14031Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~
Acta Crystallographica Section B, 2008, 64, 738-749
2104242 CIF
HKL
Paper
C10 H24 Mg N2 O13B 1 21 114.597; 14.135; 70.201
90; 96.95; 90
14378Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~
Acta Crystallographica Section B, 2008, 64, 738-749
2104243 CIF
HKL
Paper
C10 H24 N2 O13 ZnB 1 21 114.737; 14.05; 69.935
90; 96.99; 90
14373Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~
Acta Crystallographica Section B, 2008, 64, 738-749
2104244 CIF
HKL
Paper
C10 H24 N2 Ni O13C -114.719; 28.041; 10.704
90.2; 125.99; 89.87
3574.6Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~
Acta Crystallographica Section B, 2008, 64, 738-749
2104245 CIF
HKL
Paper
C10 H24 Cu N2 O13C -114.769; 27.924; 10.642
89.91; 125.88; 90.06
3556.1Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~
Acta Crystallographica Section B, 2008, 64, 738-749
2104246 CIF
HKL
Paper
C10 H24 Co N2 O13P 41 21 28.11; 8.11; 27.247
90; 90; 90
1792.1Siegler, Maxime A.; Hao, Xiang; Parkin, Sean; Brock, Carolyn Pratt
Five more phases of the structural family [<i>M</i>(H~2~O)~2~(15-crown-5)](NO~3~)~2~
Acta Crystallographica Section B, 2008, 64, 738-749
2104247 CIF
Paper
C9 H10 O2P 1 21 16.3758; 7.1703; 8.6281
90; 100.64; 90
387.66Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104248 CIF
Paper
C9 H10 O2P 1 21 16.428; 7.1935; 8.6507
90; 100.41; 90
393.42Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104249 CIF
Paper
C10 H12 O2P b c a9.1724; 7.185; 27.407
90; 90; 90
1806.2Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104250 CIF
Paper
C15 H16 N2 O3C 1 2/c 131.899; 5.4007; 20.8815
90; 128.319; 90
2822.4Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104251 CIF
Paper
C15 H16 N2 O3C 1 2 132.006; 5.4698; 20.8451
90; 128.69; 90
2848.4Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104252 CIF
Paper
C16 H18 N2 O3P -15.7543; 9.6867; 13.7434
102.056; 93.206; 103.524
723.96Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104253 CIF
Paper
C16 H18 N2 O3P 15.6984; 9.7762; 13.8553
100.011; 94.302; 103.919
732.26Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104254 CIF
Paper
C16 H18 N2 O3P 15.7059; 9.7727; 13.8321
100.323; 94.09; 103.881
731.37Lemmerer, Andreas; Báthori, Nikoletta B.; Bourne, Susan A.
Chiral carboxylic acids and their effects on melting-point behaviour in co-crystals with isonicotinamide
Acta Crystallographica Section B, 2008, 64, 780-790
2104255 CIF
Paper
C0.97 H1.21 Al0.375 N0.24 Na0.33 O6.24 Si2.625C m c m18.04416; 20.40681; 7.49986
90; 90; 90
2761.63Porcher, Florence; Borissenko, Elena; Souhassou, Mohamed; Takata, Masaki; Kato, Kenichi; Rodriguez-Carvajal, Juan; Lecomte, Claude
Synchrotron powder diffraction characterization of the zeolite-based (<i>p</i>-<i>N</i>,<i>N</i>-dimethylnitroaniline‒mordenite) guest‒host phase
Acta Crystallographica Section B, 2008, 64, 713-724
2104256 CIF
Paper
C0.97 H1.21 Al0.375 N0.24 Na0.33 O6.24 Si2.625C m c m18.08155; 20.41153; 7.501445
90; 90; 90
2768.57Porcher, Florence; Borissenko, Elena; Souhassou, Mohamed; Takata, Masaki; Kato, Kenichi; Rodriguez-Carvajal, Juan; Lecomte, Claude
Synchrotron powder diffraction characterization of the zeolite-based (<i>p</i>-<i>N</i>,<i>N</i>-dimethylnitroaniline‒mordenite) guest‒host phase
Acta Crystallographica Section B, 2008, 64, 713-724
2104257 CIF
HKL
Paper
Ba4 H2 O25 Si4 Ti6C m m m5.906; 20.618; 16.719
90; 90; 90
2035.9Cadoni, Marcella; Bloise, Andrea; Ferraris, Giovanni; Merlino, Stefano
Order‒disorder character and twinning in the structure of a new synthetic titanosilicate: (Ba,Sr)~4~Ti~6~Si~4~O~24~·H~2~O
Acta Crystallographica Section B, 2008, 64, 669-675
2104258 CIF
HKL
Paper
Ba3.2 H2 O25 Si4 Sr0.8 Ti6P 1 2/c 15.906; 16.719; 10.724
90; 105.99; 90
1017.9Cadoni, Marcella; Bloise, Andrea; Ferraris, Giovanni; Merlino, Stefano
Order‒disorder character and twinning in the structure of a new synthetic titanosilicate: (Ba,Sr)~4~Ti~6~Si~4~O~24~·H~2~O
Acta Crystallographica Section B, 2008, 64, 669-675
2104259 CIF
Paper
C45 H84 O6P -112.0497; 36.592; 5.4266
95.006; 101.463; 84.613
2328.8van Mechelen, Jan B.; Goubitz, Kees; Pop, Mihaela; Peschar, Rene; Schenk, Henk
Structures of mono-unsaturated triacylglycerols. V. The β'~1~-2, β'-3 and β~2~-3 polymorphs of 1,3-dilauroyl-2-oleoylglycerol (LaOLa) from synchrotron and laboratory powder diffraction data
Acta Crystallographica Section B, 2008, 64, 771-779
2104260 CIF
Paper
C45 H84 O6P -15.4998; 7.7359; 56.101
81.4578; 89.685; 90.213
2360.33van Mechelen, Jan B.; Goubitz, Kees; Pop, Mihaela; Peschar, Rene; Schenk, Henk
Structures of mono-unsaturated triacylglycerols. V. The β'~1~-2, β'-3 and β~2~-3 polymorphs of 1,3-dilauroyl-2-oleoylglycerol (LaOLa) from synchrotron and laboratory powder diffraction data
Acta Crystallographica Section B, 2008, 64, 771-779
2104261 CIF
HKL
Paper
C45 H84 O6C 1 c 15.4489; 104.424; 8.1428
90; 88.5014; 90
4631.64van Mechelen, Jan B.; Goubitz, Kees; Pop, Mihaela; Peschar, Rene; Schenk, Henk
Structures of mono-unsaturated triacylglycerols. V. The β'~1~-2, β'-3 and β~2~-3 polymorphs of 1,3-dilauroyl-2-oleoylglycerol (LaOLa) from synchrotron and laboratory powder diffraction data
Acta Crystallographica Section B, 2008, 64, 771-779
2104262 CIF
HKL
Paper
O8 V4 YbP 1 21/n 19.0677; 10.6261; 5.7599
90; 90.185; 90
554.99Friese, Karen; Kanke, Yasushi; Fitch, Andy N.; Morgenroth, Wolfgang; Grzechnik, Andrzej
Isosymmetrical phase transition in α-YbV~4~O~8~
Acta Crystallographica Section B, 2008, 64, 652-660
2104263 CIF
HKL
Paper
O8 V4 YbP 1 21/n 19.0651; 10.6239; 5.7539
90; 90.182; 90
554.14Friese, Karen; Kanke, Yasushi; Fitch, Andy N.; Morgenroth, Wolfgang; Grzechnik, Andrzej
Isosymmetrical phase transition in α-YbV~4~O~8~
Acta Crystallographica Section B, 2008, 64, 652-660
2104264 CIF
HKL
Paper
O8 V4 YbP 1 21/n 19.0641; 10.6229; 5.7487
90; 90.182; 90
553.52Friese, Karen; Kanke, Yasushi; Fitch, Andy N.; Morgenroth, Wolfgang; Grzechnik, Andrzej
Isosymmetrical phase transition in α-YbV~4~O~8~
Acta Crystallographica Section B, 2008, 64, 652-660
2104265 CIF
HKL
Paper
O8 V4 YbP 1 21/n 19.0675; 10.6264; 5.7473
90; 90.19; 90
553.78Friese, Karen; Kanke, Yasushi; Fitch, Andy N.; Morgenroth, Wolfgang; Grzechnik, Andrzej
Isosymmetrical phase transition in α-YbV~4~O~8~
Acta Crystallographica Section B, 2008, 64, 652-660
2104266 CIF
HKL
Paper
O8 V4 YbP 1 21/n 19.0616; 10.6244; 5.7497
90; 90.292; 90
553.54Friese, Karen; Kanke, Yasushi; Fitch, Andy N.; Morgenroth, Wolfgang; Grzechnik, Andrzej
Isosymmetrical phase transition in α-YbV~4~O~8~
Acta Crystallographica Section B, 2008, 64, 652-660
2104267 CIF
HKL
Paper
O8 V4 YbP 1 21/n 19.0469; 10.6159; 5.7814
90; 90.065; 90
555.25Friese, Karen; Kanke, Yasushi; Fitch, Andy N.; Morgenroth, Wolfgang; Grzechnik, Andrzej
Isosymmetrical phase transition in α-YbV~4~O~8~
Acta Crystallographica Section B, 2008, 64, 652-660
2104268 CIF
HKL
Paper
O8 V4 YbP 1 21/n 19.0461; 10.6156; 5.7812
90; 90.068; 90
555.17Friese, Karen; Kanke, Yasushi; Fitch, Andy N.; Morgenroth, Wolfgang; Grzechnik, Andrzej
Isosymmetrical phase transition in α-YbV~4~O~8~
Acta Crystallographica Section B, 2008, 64, 652-660
2104269 CIF
HKL
Paper
Ca2 Co2.511 O6.138X2/m4.839; 4.553; 10.858
90; 98.12; 90
236.825Muguerra, Hervé; Grebille, Dominique
Original disorder‒order transition related to electronic and magnetic properties in the thermoelectric misfit phase [Ca~2~CoO~3~][CoO~2~]~1.62~
Acta Crystallographica Section B, 2008, 64, 676-683
2104270 CIF
HKL
Paper
Pb SBmmm(0\b0)s0013.737; 1.7496; 4.1448
90; 90; 90
99.617Elcoro, Luis; Perez-Mato, J. M.; Friese, Karen; Petříček, Václav; Balić-Žunić, Tonči; Olsen, Lars Arnskov
Modular crystals as modulated structures: the case of the lillianite homologous series
Acta Crystallographica Section B, 2008, 64, 684-701
2104271 CIF
HKL
Paper
C6 H15 Cl N2 O3P 21 21 215.4315; 9.8019; 17.3505
90; 90; 90
923.72Dittrich, B.; McKinnon, J. J.; Warren, J. E.
Improvement of anisotropic displacement parameters from invariom-model refinements for three <small>L</small>-hydroxylysine structures
Acta Crystallographica Section B, 2008, 64, 750-759
2104272 CIF
HKL
Paper
C6 H16 Cl2 N2 O3P 1 21 18.6224; 7.0489; 9.8061
90; 106.486; 90
571.5Dittrich, B.; McKinnon, J. J.; Warren, J. E.
Improvement of anisotropic displacement parameters from invariom-model refinements for three <small>L</small>-hydroxylysine structures
Acta Crystallographica Section B, 2008, 64, 750-759
2104273 CIF
HKL
Paper
C6 H18 Cl2 N2 O4P 15.4491; 7.3962; 8.1337
79.382; 73.191; 69.544
292.75Dittrich, B.; McKinnon, J. J.; Warren, J. E.
Improvement of anisotropic displacement parameters from invariom-model refinements for three <small>L</small>-hydroxylysine structures
Acta Crystallographica Section B, 2008, 64, 750-759
2104274 CIF
Paper
Ce10 O81 W22P b n m3.8891; 36.08; 21.901
90; 90; 90
3073.1Barker, Rosemary S.; Radosavljevic Evans, Ivana
Structural characterization of RE~10~W~22~O~81~ rare-earth tungstates (RE = Ce, Nd)
Acta Crystallographica Section B, 2008, 64, 708-712
9017322 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2055; 10.2055; 7.4483
90; 90; 120
671.825Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 298 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017323 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2224; 10.2224; 7.4494
90; 90; 120
674.152Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 373 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017324 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2323; 10.2323; 7.4533
90; 90; 120
675.812Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 423 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017325 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2415; 10.2415; 7.4594
90; 90; 120
677.582Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 473 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017326 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2055; 10.2055; 7.4483
90; 90; 120
671.825Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 298 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017327 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2055; 10.2055; 7.4483
90; 90; 120
671.825Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 298 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017328 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2224; 10.2224; 7.4494
90; 90; 120
674.152Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 373 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017329 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2224; 10.2224; 7.4494
90; 90; 120
674.152Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 373 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017330 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2323; 10.2323; 7.4533
90; 90; 120
675.812Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 423 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017331 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2323; 10.2323; 7.4533
90; 90; 120
675.812Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 423 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017332 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2415; 10.2415; 7.4594
90; 90; 120
677.582Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 473 K
Acta Crystallographica, Section B, 2008, 64, 34-41
9017333 CIFAs3 Cl0.74 O12.13 Pb5P 63/m10.2415; 10.2415; 7.4594
90; 90; 120
677.582Baikie, T.; Ferraris, C.; Klooster, W. T.; Madhavi, S.; Pramana, S. S.; Pring, A.; Schmidt, G.; White, T. J.
Crystal chemistry of mimetite, Pb10(AsO4)6Cl1.48O0.26, and finnemanite, Pb10(AsO3)6Cl2 Note: T = 473 K
Acta Crystallographica, Section B, 2008, 64, 34-41

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