Information card for entry 1575757

Structure parameters

• Formula: C48 H58 B Br Fe Mo S3
• Calculated formula: C48 H58 B Br Fe Mo S3
• Title of publication: A bioinspired hetero-binuclear iron-molybdenum complex supported by tridentate sulfur donors and its catalytic activity toward hydrazine disproportionation.
• Authors of publication: Xu, Xiang; Du, Ronghuan; Sun, Luyang; Yang, Dawei; Wang, Baomin; Qu, Jingping
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 39
• Pages of publication: 14862 - 14867
• a: 11.5965 ± 0.0009 Å
• b: 11.742 ± 0.0009 Å
• c: 32.531 ± 0.003 Å
• α: 84.038 ± 0.003°
• β: 85.377 ± 0.003°
• γ: 82.441 ± 0.003°
• Cell volume: 4357.3 ± 0.6 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0689
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.1011
• Weighted residual factors for all reflections included in the refinement: 0.1103
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No