Crystallography Open Database

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Searching journal of publication like 'IUCrJ' volume of publication is 6

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1550342 CIF
Paper		C15.5 H17 Cu N3.5 O5.75P 1 21/c 110.8431; 11.8835; 14.4823
90; 109.361; 90		1760.57Wang, Sujuan; Wei, Zhang-Wen; Zhang, Jianyong; Jiang, Long; Liu, Dingxin; Jiang, Ji-Jun; Si, Rui; Su, Cheng-Yong
Framework disorder and its effect on selective hysteretic sorption of a T-shaped azole-based metal‒organic framework
IUCrJ, 2019, 6
1550370 CIF
Paper		C4 H9 Co N O6P n m a8.2674; 11.66; 8.1483
90; 90; 90		785.48Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan
Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound
IUCrJ, 2019, 6, 105-115
1550371 CIF
Paper		C4 H9 Co N O6P n m a8.2556; 11.6519; 8.1508
90; 90; 90		784.05Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan
Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound
IUCrJ, 2019, 6, 105-115
1550372 CIF
Paper		C4 H9 Co N O6P n m a8.2702; 11.6766; 8.1631
90; 90; 90		788.29Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan
Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound
IUCrJ, 2019, 6, 105-115
1550373 CIF
Paper		C4 H9 Co N O6P n m a8.2548; 11.6547; 8.1521
90; 90; 90		784.29Canadillas-Delgado, Laura; Mazzuca, Lidia; Fabelo, Oscar; Rodriguez-Velamazan, J. Alberto; Rodriguez-Carvajal, Juan
Incommensurate structures of the [CH~3~NH~3~][Co(COOH)~3~] compound
IUCrJ, 2019, 6, 105-115
1550383 CIFAl2 Eu4 F2 O8P 1 21/c 17.5885; 10.8399; 11.0776
90; 108.788; 90		862.67Morán-Ruiz, Aroa; Wain-Martin, Aritza; Orera, Alodia; Sanjuán, María Luisa; Larrañaga, Aitor; Slater, Peter R.; Arriortua, Maribel
Synthesis of new Ln~4~(Al~2~O~6~F~2~)O~2~ (Ln = Sm, Eu, Gd) phases with a cuspidine-related structure
IUCrJ, 2019, 6, 128-135
1550384 CIFAl2 F2 O8 Sm4P 1 21/c 17.6188; 10.8705; 11.1077
90; 108.805; 90		870.84Morán-Ruiz, Aroa; Wain-Martin, Aritza; Orera, Alodia; Sanjuán, María Luisa; Larrañaga, Aitor; Slater, Peter R.; Arriortua, Maribel
Synthesis of new Ln~4~(Al~2~O~6~F~2~)O~2~ (Ln = Sm, Eu, Gd) phases with a cuspidine-related structure
IUCrJ, 2019, 6, 128-135
1550439 CIFC16 H26P 1 21/n 114.3334; 5.56223; 8.53021
90; 92.0219; 90		679.65van de Streek, Jacco; Alig, Edith; Parsons, Simon; Vella-Zarb, Liana
A jumping crystal predicted with molecular dynamics and analysed with TLS refinement against powder diffraction data
IUCrJ, 2019, 6, 136-144
1550440 CIFC7 H15 Cl N2 OP 1 21 17.2588; 8.9399; 22.7927
90; 95.818; 90		1471.47Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550441 CIFC7 H15 I N2 OP b c a13.4725; 9.8551; 32.7259
90; 90; 90		4345.11Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550442 CIFC7 H15 Cl N2 OP 1 21 17.2902; 8.9099; 7.8789
90; 107.024; 90		489.35Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550443 CIFC7 H15 Br N2 OP 1 21 17.5269; 9.1017; 7.93
90; 107.161; 90		519.08Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550444 CIFC7 H15 I N2 OP 21 21 217.585; 10.8242; 13.0468
90; 90; 90		1071.16Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550445 CIFC14 H30 B Cl F4 N4 O2P 21 21 219.4006; 13.2619; 16.6581
90; 90; 90		2076.76Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550446 CIFC22 H27 Br N2 O4 SP 21 21 216.106; 9.0317; 42.33
90; 90; 90		2334.4Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550447 CIFC22 H27 I N2 O4 SP 21 21 216.2219; 9.0228; 43.0569
90; 90; 90		2417.17Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550448 CIFC22 H27 N3 O7 SP 21 21 216.3765; 8.8174; 42.942
90; 90; 90		2414.38Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550449 CIFC22 H32 N2 O9.5 P SP 18.7929; 12.6645; 23.7867
82.3345; 81.4117; 89.9824		2595.2Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550450 CIFC15 H24 N2 O5P 1 21 111.47377; 6.14747; 11.71348
90; 111.978; 90		766.164Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550451 CIFC19 H23 Cl N6 O4P 1 21/c 112.6065; 13.0726; 12.6694
90; 106.397; 90		2003Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550452 CIFC20 H23 Cl N6 O SP -112.1482; 13.1848; 13.8251
90.263; 90.218; 108.005		2105.9Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550453 CIFC19 H23 B Cl F4 N5 OP 1 21/c 112.46473; 12.98315; 13.42014
90; 106.765; 90		2079.49Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550454 CIFC16 H21 N O4 SP 1 21 15.72587; 20.83882; 6.92054
90; 98.3547; 90		816.998Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550455 CIFC24 H38 N2 O8P 15.8213; 7.27088; 15.90214
94.7215; 96.6693; 109.525		624.781Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550456 CIFC24 H38 N2 O9P 1 21 16.07189; 32.9414; 7.1383
90; 114.168; 90		1302.63Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550457 CIFC10 H16 N2 O4P 1 21 16.0401; 29.3553; 7.3828
90; 112.806; 90		1206.7Babor, Martin; Nievergelt, Philipp P.; Čejka, Jan; Zvoníček, Vít; Spingler, Bernhard
Microbatch under-oil salt screening of organic cations: single-crystal growth of active pharmaceutical ingredients
IUCrJ, 2019, 6, 145-151
1550520 CIF
Paper		C12 H16 N4 O6P 1 21/c 114.0525; 7.8134; 12.8242
90; 91.848; 90		1407.34Gryl, Marlena; Rydz, Agnieszka; Wojnarska, Joanna; Krawczuk, Anna; Kozieł, Marcin; Seidler, Tomasz; Ostrowska, Katarzyna; Marzec, Monika; Stadnicka, Katarzyna Marta
Origin of chromic effects and crystal-to-crystal phase transition in the polymorphs of tyraminium violurate
IUCrJ, 2019, 6
1550521 CIF
Paper		C12 H14 N4 O5P 1 21/c 16.8711; 15.119; 11.884
90; 91.858; 90		1233.9Gryl, Marlena; Rydz, Agnieszka; Wojnarska, Joanna; Krawczuk, Anna; Kozieł, Marcin; Seidler, Tomasz; Ostrowska, Katarzyna; Marzec, Monika; Stadnicka, Katarzyna Marta
Origin of chromic effects and crystal-to-crystal phase transition in the polymorphs of tyraminium violurate
IUCrJ, 2019, 6
1550522 CIF
Paper		C12 H14 N4 O5P 1 21/c 113.2706; 7.651; 13.1269
90; 102.097; 90		1303.22Gryl, Marlena; Rydz, Agnieszka; Wojnarska, Joanna; Krawczuk, Anna; Kozieł, Marcin; Seidler, Tomasz; Ostrowska, Katarzyna; Marzec, Monika; Stadnicka, Katarzyna Marta
Origin of chromic effects and crystal-to-crystal phase transition in the polymorphs of tyraminium violurate
IUCrJ, 2019, 6
1551103 CIF
Paper		C8 H19 N O3P 1 21 19.6559; 29.8416; 30.1248
90; 98.54; 90		8584.1Khandavilli, U. B. Rao; Lusi, Matteo; Frawley, Patrick J.
Plasticity in zwitterionic drugs: the bending properties of Pregabalin and Gabapentin and their hydrates
IUCrJ, 2019, 6
1551104 CIFC8 H19 N O3C 1 2 19.566; 7.44; 15.911
90; 101.54; 90		1109.5Khandavilli, U. B. Rao; Lusi, Matteo; Frawley, Patrick J.
Plasticity in zwitterionic drugs: the bending properties of Pregabalin and Gabapentin and their hydrates
IUCrJ, 2019, 6
1551412 CIF
Paper		C16 H36 N8 Ni O13P 21 21 218.949; 15.4457; 19.2674
90; 90; 90		2663.2Christensen, Jeppe; Horton, Peter N.; Bury, Charles S.; Dickerson, Joshua L.; Taberman, Helena; Garman, Elspeth F.; Coles, Simon J.
Radiation damage in small-molecule crystallography: fact not fiction
IUCrJ, 2019, 6
1551854 CIF
Paper		C22 H19 F3 N4 O3 SP 1 21/n 114.5182; 8.2844; 17.8349
90; 93.899; 90		2140.1Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551855 CIFC23 H21 F3 N4 O3 SP -110.0694; 10.6113; 12.6499
113.451; 100.897; 101.744		1157.9Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551856 CIFC24 H20 F6 N4 O3 SP -17.4563; 13.01; 13.7231
100.17; 95.715; 104.444		1254.4Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551857 CIFC23 H21 F3 N4 O4 SP -17.6112; 11.3462; 15.1063
105.897; 102.702; 101.93		1173.4Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551858 CIFC17 H21 Cl N3 O6.5 SC 1 2/c 123.819; 8.4372; 23.45
90; 123.868; 90		3913Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551859 CIFC18 H22 Cl N3 O6 SP -18.5442; 11.3615; 12.1409
63.447; 88.724; 75.712		1016.37Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551860 CIFC17 H22 Cl N3 O7 SP 1 21/n 111.116; 8.447; 21.388
90; 93.12; 90		2005.3Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551861 CIFC12 H13 Cl N4 O5 S2P 1 21/c 16.8039; 13.5399; 18.8949
90; 113.113; 90		1601Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551862 CIFC12 H13 Cl N4 O5 S2P n a 2129.442; 7.3421; 7.0867
90; 90; 90		1531.9Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551863 CIFC17 H26 Cl N5 O6 S2P -18.693; 10.6472; 12.8556
113.672; 98.9; 95.358		1060.61Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1551864 CIFC19 H30 Cl N5 O6 S2P b c a11.8873; 19.315; 21.733
90; 90; 90		4990Bolla, Geetha; Nangia, Ashwini
Supramolecular synthon hierarchy in sulfonamide cocrystals with <i>syn</i>-amides and <i>N</i>-oxides
IUCrJ, 2019, 6
1552087 CIF
Paper		O192 Si96P n m a19.98; 20.43; 13.61
90; 90; 90		5555.48Wang, Bin; Zou, Xiaodong; Smeets, Stef
Automated serial rotation electron diffraction combined with cluster analysis: an efficient multi-crystal workflow for structure determination
IUCrJ, 2019, 6
1552088 CIFO192 Si96P n m a20.58; 19.6; 13.74
90; 90; 90		5542.28Wang, Bin; Zou, Xiaodong; Smeets, Stef
Automated serial rotation electron diffraction combined with cluster analysis: an efficient multi-crystal workflow for structure determination
IUCrJ, 2019, 6
1552089 CIFO192 Si96P n m a20.39; 20.08; 13.57
90; 90; 90		5555.98Wang, Bin; Zou, Xiaodong; Smeets, Stef
Automated serial rotation electron diffraction combined with cluster analysis: an efficient multi-crystal workflow for structure determination
IUCrJ, 2019, 6
1552090 CIFO128 Si64C m c m18.12; 20; 7.7
90; 90; 90		2790.48Wang, Bin; Zou, Xiaodong; Smeets, Stef
Automated serial rotation electron diffraction combined with cluster analysis: an efficient multi-crystal workflow for structure determination
IUCrJ, 2019, 6
1552091 CIFO5280 Si2640I m -3 m55.07; 55.07; 55.07
90; 90; 90		167011Wang, Bin; Zou, Xiaodong; Smeets, Stef
Automated serial rotation electron diffraction combined with cluster analysis: an efficient multi-crystal workflow for structure determination
IUCrJ, 2019, 6
1552092 CIFO2880 Si1440I m -3 m45.07; 45.07; 45.07
90; 90; 90		91550.9Wang, Bin; Zou, Xiaodong; Smeets, Stef
Automated serial rotation electron diffraction combined with cluster analysis: an efficient multi-crystal workflow for structure determination
IUCrJ, 2019, 6
1552093 CIFC192 O96.16 Ti16 Zr4I -4 2 m16.5; 16.5; 29.8
90; 90; 90		8113Wang, Bin; Zou, Xiaodong; Smeets, Stef
Automated serial rotation electron diffraction combined with cluster analysis: an efficient multi-crystal workflow for structure determination
IUCrJ, 2019, 6

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