Crystallography Open Database

Result : There are 8 entries in the selection

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Searching journal of publication like 'Faraday discussions' volume of publication is 211

COD ID: 1549372
CIF file Formula: - C12 H9 N3 O2 S -
Comments: Tan, Melissa; Shtukenberg, Alexander G.; Zhu, Shengcai; Xu, Wenqian; Dooryhee, Eric; Nichols, Shane M.; Ward, Michael D.; Kahr, Bart; Zhu, Qiang ROY revisited, again: the eighth solved structure. Faraday discussions 211 (2018) 477-491
Space group: P 1 21 1
Cell volume: 1200.68
Cell parameters: 10.77117; 11.01902; 11.43023; 90; 117.742; 90;  

COD ID: 1549732
CIF file Formula: - C22 H23 Cl N2 O2 -
Comments: Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions 211 (2018) 209-234
Space group: C 1 2/c 1
Cell volume: 3772
Cell parameters: 27.997; 4.918; 28.971; 90; 108.987; 90;  

COD ID: 1549733
CIF file Formula: - C22 H23 Cl N2 O2 -
Comments: Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions 211 (2018) 209-234
Space group: C 1 2/c 1
Cell volume: 3747
Cell parameters: 35.652; 5.206; 22.743; 90; 117.418; 90;  

COD ID: 1549734
CIF file Formula: - C22 H23 Cl N2 O2 -
Comments: Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions 211 (2018) 209-234
Space group: C 1 2/c 1
Cell volume: 3702
Cell parameters: 27.844; 4.867; 28.892; 90; 108.98; 90;  

COD ID: 1549735
CIF file Formula: - C22 H23 Cl N2 O2 -
Comments: Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions 211 (2018) 209-234
Space group: C 1 2/c 1
Cell volume: 3967
Cell parameters: 28.502; 5.051; 29.231; 90; 109.51; 90;  

COD ID: 1549736
CIF file Formula: - C22 H23 Cl N2 O2 -
Comments: Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions 211 (2018) 209-234
Space group: C 1 2/c 1
Cell volume: 3894
Cell parameters: 28.301; 4.998; 29.154; 90; 109.217; 90;  

COD ID: 1549737
CIF file Formula: - C22 H23 Cl N2 O2 -
Comments: Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions 211 (2018) 209-234
Space group: C 1 2/c 1
Cell volume: 3857
Cell parameters: 28.201; 4.972; 29.106; 90; 109.077; 90;  

COD ID: 1549738
CIF file Formula: - C22 H23 Cl N2 O2 -
Comments: Woollam, Grahame R.; Neumann, Marcus A.; Wagner, Trixie; Davey, Roger J. The importance of configurational disorder in crystal structure prediction: the case of loratadine. Faraday discussions 211 (2018) 209-234
Space group: C 1 2/c 1
Cell volume: 3728.9
Cell parameters: 27.906; 4.886; 28.927; 90; 109.016; 90;  


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