Information card for entry 7103159

Structure parameters

• Formula: C32 H66 Ni P2
• Calculated formula: C32 H66 Ni P2
• SMILES: C(CCC)[P](CCCC)([Ni]123([CH]4CC[CH]3=[CH]1CC[CH]2=4)[P](CCCC)(CCCC)CCCC)CCCC
• Title of publication: White phosphorus as single source of "P" in the synthesis of nickel phosphide.
• Authors of publication: Carenco, Sophie; Resa, Irene; Le Goff, Xavier; Le Floch, Pascal; Mézailles, Nicolas
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 22
• Pages of publication: 2568 - 2570
• a: 21.777 ± 0.001 Å
• b: 8.967 ± 0.001 Å
• c: 17.218 ± 0.001 Å
• α: 90°
• β: 90.769 ± 0.001°
• γ: 90°
• Cell volume: 3361.9 ± 0.5 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0495
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0938
• Weighted residual factors for all reflections included in the refinement: 0.0995
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No