Information card for entry 2019487

Structure parameters

• Chemical name: <i>catena</i>-Poly[[[diaqua(methanol-κ<i>O</i>)copper(II)]-μ-<i>N</i>-(4-methylpyrimidin-2-yl-κ<i>N</i>^1^)pyrazin-2-amine-κ^2^<i>N</i>^1^:<i>N</i>^4^] [[aqua(aqua/methanol-κ<i>O</i>)(perchlorato-κ<i>O</i>)copper(II)]-μ-<i>N</i>-(4-methylpyrimidin-2-yl-κ<i>N</i>^1^)pyrazin-2-amine-κ^2^<i>N</i>^1^:<i>N</i>^4^] tris(perchlorate) methanol monosolvate 1.42-hydrate]
• Formula: C20.58 H38 Cl4 Cu2 N10 O23.42
• Calculated formula: C20.581 H37.162 Cl4 Cu2 N10 O23.419
• Title of publication: A coordination polymer consisting of two different one-dimensional copper(II) chains
• Authors of publication: Wu, Yang; Wang, Wen-Zhen; Ismayilov, Rayyat Huseyn; Lee, Gene-Hsiang; Peng, Shie-Ming
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 3
• Pages of publication: 285 - 288
• a: 15.0769 ± 0.0004 Å
• b: 20.0774 ± 0.0007 Å
• c: 13.7166 ± 0.0003 Å
• α: 90°
• β: 103.711 ± 0.0015°
• γ: 90°
• Cell volume: 4033.8 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1133
• Residual factor for significantly intense reflections: 0.0636
• Weighted residual factors for significantly intense reflections: 0.1703
• Weighted residual factors for all reflections included in the refinement: 0.1938
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes