Information card for entry 7252077

Structure parameters

• Formula: C25 H26 Cl2 Mn2 N2 O5
• Calculated formula: C25 H26 Cl2 Mn2 N2 O5
• Title of publication: Coordination pyramid inversion, angular cluster core and homochiral single-stranded helix formation in polynuclear Mn(ii) assemblies supported by a bicompartmental salen-type ligand based on an o-xylylenediamine platform
• Authors of publication: Shutilov, Ilia D.; Volodin, Pavel A.; Frantsuzova, Lyubov V.; Gubaidullin, Aidar T.; Ovsyannikov, Alexander S.; Solovieva, Svetlana E.; Antipin, Igor S.
• Journal of publication: CrystEngComm
• Year of publication: 2026
• Journal volume: 28
• Journal issue: 20
• Pages of publication: 3232 - 3240
• a: 13.2446 ± 0.0012 Å
• b: 13.5462 ± 0.0011 Å
• c: 14.0213 ± 0.0012 Å
• α: 90°
• β: 93.617 ± 0.003°
• γ: 90°
• Cell volume: 2510.6 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0348
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0771
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No