Information card for entry 4308011

Structure parameters

• Formula: C18 H26
• Calculated formula: C18 H26
• SMILES: C1=C(C(=C([C@@]1([C@]1(C=C(C(=C1C)C)C)C)C)C)C)C
• Title of publication: Solid-State Structures and Solution Studies of Novel Cyclopentadienyl Mercury Compounds
• Authors of publication: Abdessamad Grirrane; Irene Resa; Diego del Río; Amor Rodríguez; Eleuterio Álvarez; Kurt Mereiter; Ernesto Carmona
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Pages of publication: 4667 - 4676
• a: 6.9998 ± 0.0004 Å
• b: 7.5808 ± 0.0004 Å
• c: 8.3361 ± 0.0004 Å
• α: 64.618 ± 0.001°
• β: 68.721 ± 0.001°
• γ: 69.637 ± 0.001°
• Cell volume: 362.55 ± 0.03 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 2
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0411
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1106
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 4307996
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No