Information card for entry 7243296

Structure parameters

• Formula: C40 H41 Co N10 O11
• Calculated formula: C40 H41 Co N10 O11
• SMILES: [Co](C#N)(C#N)(C#N)(C#N)(C#N)C#N.[n+]1(ccc(c2cc[nH+]cc2)cc1)c1ccc(cc1)C(=O)[O-].[n+]1(c2ccc(cc2)C(=O)O)ccc(c2cc[nH+]cc2)cc1.O.O.O.O.O.O.O
• Title of publication: Salts, solvates and hydrates of the multi-kinase inhibitor drug pazopanib with hydroxybenzoic acids
• Authors of publication: Rai, Sunil K.; Baidya, Debjani; Nangia, Ashwini K.
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 35
• Pages of publication: 5994 - 6011
• a: 10.5802 ± 0.0008 Å
• b: 14.8763 ± 0.001 Å
• c: 15.6669 ± 0.0011 Å
• α: 64.083 ± 0.007°
• β: 86.853 ± 0.006°
• γ: 72.573 ± 0.007°
• Cell volume: 2107.8 ± 0.3 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0885
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1086
• Weighted residual factors for all reflections included in the refinement: 0.1195
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No