Information card for entry 2206678

Structure parameters

• Chemical name: di-μ-aqua-1:2κ^4^O:O-triaqua-1κ^3^O-dilosartanido-1κN;2κ^2^N,N'- dipotassium dihydrate
• Formula: C22 H29 Cl K N6 O4.5
• Calculated formula: C22 H29 Cl K N6 O4.5
• SMILES: [K+].Clc1nc(n(Cc2ccc(c3c(c4[n-]nnn4)cccc3)cc2)c1CO)CCCC.O.O.O.O
• Title of publication: Losartan potassium 3.5-hydrate, a new crystalline form
• Authors of publication: Xiu-Rong Hu; Yun-Wu Wang; Jian-Ming Gu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 9
• Pages of publication: m1686 - m1688
• a: 13.1389 ± 0.0003 Å
• b: 25.6885 ± 0.0005 Å
• c: 31.1822 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10524.6 ± 0.4 ų
• Cell temperature: 295 ± 1 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for all reflections included in the refinement: 0.124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes