Information card for entry 7232181

Structure parameters

• Formula: C29 H20 B Cl2 F4 N5 Ru
• Calculated formula: C29 H20 B Cl2 F4 N5 Ru
• Title of publication: Photoisomerization and thermal isomerization of ruthenium aqua complexes with chloro-substituted asymmetric bidentate ligands
• Authors of publication: Hirahara, Masanari; Goto, Hiroki; Yamamoto, Rei; Yagi, Masayuki; Umemura, Yasushi
• Journal of publication: RSC Advances
• Year of publication: 2019
• Journal volume: 9
• Journal issue: 4
• Pages of publication: 2002
• a: 7.7286 ± 0.0012 Å
• b: 12.0747 ± 0.0018 Å
• c: 14.592 ± 0.002 Å
• α: 81.76 ± 0.002°
• β: 89.511 ± 0.002°
• γ: 77.947 ± 0.002°
• Cell volume: 1317.6 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0479
• Residual factor for significantly intense reflections: 0.0312
• Weighted residual factors for significantly intense reflections: 0.0609
• Weighted residual factors for all reflections included in the refinement: 0.0728
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0393
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No