Information card for entry 4347360

Structure parameters

• Formula: C20 H38 B8 Ir2
• Calculated formula: C20 H38 B8 Ir2
• SMILES: [c]12([c]3([c]4([c]5([c]1(C)[Ir]167892345[BH]234[BH]51[BH]1%106[BH]67[BH]7%118[BH]92[BH]237[BH]16%11[Ir]136745%102[c]2([c]1([c]3([c]6([c]72C)C)C)C)C)C)C)C)C
• Title of publication: Hypoelectronic 8-11-Vertex Irida- and Rhodaboranes.
• Authors of publication: Roy, Dipak Kumar; Borthakur, Rosmita; Prakash, Rini; Bhattacharya, Somnath; Jagan, Rajamony; Ghosh, Sundargopal
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 10
• Pages of publication: 4764 - 4770
• a: 23.9473 ± 0.001 Å
• b: 23.9473 ± 0.001 Å
• c: 9.1337 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5237.9 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 106
• Hermann-Mauguin space group symbol: P 42 b c
• Hall space group symbol: P 4c -2ab
• Residual factor for all reflections: 0.0471
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0654
• Weighted residual factors for all reflections included in the refinement: 0.076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.229
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No