Information card for entry 4335302

Structure parameters

• Formula: C20 H34 B4 Mo2 Te2
• Calculated formula: C20 H34 B4 Mo2 Te2
• SMILES: [Mo]123456789%10([Mo]%11%12%13%14%15%16%17%18%19([Te]1[BH]3%12[BH]4%13[BH]5%14[BH]6%15[Te]2%11)[c]1([c]%16([c]%17([c]%18([c]%191C)C)C)C)C)[c]1([c]7([c]8([c]9([c]%101C)C)C)C)C
• Title of publication: Correction to Theoretical and Experimental Investigations on Hypoelectronic Heterodimetallaboranes of Group 6 Transition Metals
• Authors of publication: Bellie Sundaram Krishnamoorthy; Arunabha Thakur; Kiran Kumar Varma Chakrahari; Shubhankar Kumar Bose; Paul Hamon; Thierry Roisnel; Samia Kahlal; Sundargopal Ghosh; Jean-François Halet
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 7305 - 7305
• a: 15.8507 ± 0.0003 Å
• b: 14.7628 ± 0.0003 Å
• c: 21.2848 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4980.66 ± 0.17 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0633
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.1408
• Weighted residual factors for all reflections included in the refinement: 0.1452
• 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