Information card for entry 7239391

Structure parameters

• Formula: C88 H56 Fe12 O20 Te2
• Calculated formula: C88 H56 Fe12 O20 Te2
• Title of publication: Some unusual reactions of metal carbonyls with (Z)-1-ferrocenyltelluro-1-ferrocenyl-4-ferrocenyl-1-buten-3-yne
• Authors of publication: Mathur, Pradeep; Tauqeer, Mohd.; Ji, Radhe Shyam; Lahiri, Goutam K.; Mobin, Shaikh M.
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 14
• Pages of publication: 6878
• a: 22.3039 ± 0.0003 Å
• b: 22.5704 ± 0.0003 Å
• c: 16.485 ± 0.0002 Å
• α: 90°
• β: 102.921 ± 0.001°
• γ: 90°
• Cell volume: 8088.55 ± 0.18 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• 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: 0.0518
• Residual factor for significantly intense reflections: 0.0323
• Weighted residual factors for significantly intense reflections: 0.0605
• Weighted residual factors for all reflections included in the refinement: 0.0678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No