Information card for entry 2200336

Structure parameters

• Common name: Tricarbonylchromium dihydroacenaphthylene complex
• Chemical name: exo-(±)-Tricarbonyl(η^6^-1-hydroxy-1,2-dihydroacenaphthylene)chromium(0)
• Formula: C15 H10 Cr O4
• Calculated formula: C15 H10 Cr O4
• SMILES: [Cr]12345(C#[O])(C#[O])(C#[O])[c]67[c]85[cH]4[cH]3[cH]2[c]16C(O)Cc7ccc8
• Title of publication: <i>exo</i>-(±)-Tricarbonyl(η^6^-1-hydroxy-1,2-dihydroacenaphthylene)chromium(0)
• Authors of publication: Parvez, Masood; Simion, Dan V.; Sorensen, Ted S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 5
• Pages of publication: m204 - m206
• a: 10.0838 ± 0.0016 Å
• b: 25.963 ± 0.004 Å
• c: 10.1696 ± 0.0017 Å
• α: 90°
• β: 95.641 ± 0.014°
• γ: 90°
• Cell volume: 2649.6 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.253
• Residual factor for significantly intense reflections: 0.047
• Weighted residual factors for all reflections included in the refinement: 0.161
• Goodness-of-fit parameter for all reflections included in the refinement: 0.95
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes