Information card for entry 4342183

Structure parameters

• Chemical name: 1,3-Di-tert-butyl-2,4-bis(phenylethynyl)-[1,3,2,4] diazadiphosphetidine
• Formula: C24 H28 N2 P2
• Calculated formula: C24 H28 N2 P2
• SMILES: P1(N(P(N1C(C)(C)C)C#Cc1ccccc1)C(C)(C)C)C#Cc1ccccc1
• Title of publication: Construction of the First Rhodium(I) Cyclic Pentameric Structure [Rh(CO)Cl{(μ-N(t)BuP)2(C≡CPh)2}]5 Using (Phenylethynyl)cyclodiphosphazanes.
• Authors of publication: Siddiqui, Mujahuddin M.; Mague, Joel T.; Balakrishna, Maravanji S.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 4
• Pages of publication: 1200 - 1202
• a: 15.6716 ± 0.0011 Å
• b: 10.4009 ± 0.0007 Å
• c: 15.5875 ± 0.001 Å
• α: 90°
• β: 115.172 ± 0.001°
• γ: 90°
• Cell volume: 2299.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0444
• Residual factor for significantly intense reflections: 0.0362
• Weighted residual factors for significantly intense reflections: 0.0944
• Weighted residual factors for all reflections included in the refinement: 0.1019
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No