Information card for entry 4069049

Structure parameters

• Formula: C41 H39 Fe Ga O5 P2 W
• Calculated formula: C41 H39 Fe Ga O5 P2 W
• SMILES: [W]([Ga][Fe]12345([P](c6ccccc6)(c6ccccc6)CC[P]1(c1ccccc1)c1ccccc1)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Synthesis and Structure of the First Gallium-Bridged Heterodimetallic Complexes, Cp*(dppe)FeGaM(CO)5(Cp* = η5-C5Me5, dppe = Ph2P(CH2)2PPh2, M = Cr, W)
• Authors of publication: Muraoka, Takako; Motohashi, Hideaki; Kazuie, Yasuhiro; Takizawa, Akira; Ueno, Keiji
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 6
• Pages of publication: 1616
• a: 16.9896 ± 0.0005 Å
• b: 10.6919 ± 0.0002 Å
• c: 22.3657 ± 0.0009 Å
• α: 90°
• β: 110.269 ± 0.0004°
• γ: 90°
• Cell volume: 3811.2 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.0635
• Residual factor for significantly intense reflections: 0.0632
• Weighted residual factors for significantly intense reflections: 0.1232
• Weighted residual factors for all reflections included in the refinement: 0.1233
• Goodness-of-fit parameter for all reflections included in the refinement: 1.314
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No