Information card for entry 2006940

Structure parameters

• Chemical name: trans-chloro-bis[ethylene-bis(diethylphosphine)]hydrido-iron(II)
• Formula: C20 H49 Cl Fe P4
• Calculated formula: C20 H49 Cl Fe P4
• SMILES: [FeH]12(Cl)([P](CC)(CC)CC[P]1(CC)CC)[P](CC)(CC)CC[P]2(CC)CC
• Title of publication: [FeHCl(C~10~H~24~P~2~)~2~]
• Authors of publication: Wiesler, Beatrix; Tuczek, Felix; Näther, Christian; Bensch, Wolfgang
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 1
• Pages of publication: 44 - 46
• a: 10.747 ± 0.002 Å
• b: 27.457 ± 0.004 Å
• c: 17.837 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5263.3 ± 1.5 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0823
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for all reflections: 0.1568
• Weighted residual factors for significantly intense reflections: 0.126
• Goodness-of-fit parameter for all reflections: 1.073
• Goodness-of-fit parameter for significantly intense reflections: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No