Information card for entry 4337583

Structure parameters

• Common name: Zn2DPO.CHDA
• Formula: C164 H182 N20 O2 Zn4
• Calculated formula: C164 H182 N20 O2 Zn4
• Title of publication: Synthesis, structure, and properties of a series of chiral tweezer-diamine complexes consisting of an achiral zinc(II) bisporphyrin host and chiral diamine guest: induction and rationalization of supramolecular chirality.
• Authors of publication: Brahma, Sanfaori; Ikbal, Sk Asif; Rath, Sankar Prasad
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 1
• Pages of publication: 49 - 62
• a: 24.136 ± 0.005 Å
• b: 13.526 ± 0.005 Å
• c: 24.539 ± 0.005 Å
• α: 90 ± 0.005°
• β: 116.872 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 7146 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0933
• Residual factor for significantly intense reflections: 0.0593
• Weighted residual factors for significantly intense reflections: 0.1319
• Weighted residual factors for all reflections included in the refinement: 0.1501
• Goodness-of-fit parameter for all reflections included in the refinement: 0.984
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No