Information card for entry 4347483

Structure parameters

• Formula: C54 H56 Bi2 Cl2 P2
• Calculated formula: C54 H56 Bi2 Cl2 P2
• SMILES: [Bi]1(P(c2c(cccc2c2c(cc(cc2C)C)C)c2c(cc(cc2C)C)C)[Bi](Cl)P1c1c(cccc1c1c(cc(cc1C)C)C)c1c(cc(cc1C)C)C)Cl.c1ccccc1
• Title of publication: Synthesis of Heavy Cyclodipnictadiphosphanes [ClE(μ-P-Ter)]2 [E = P, As, Sb, or Bi; Ter = 2,6-bis(2,4,6-trimethylphenyl)phenyl].
• Authors of publication: Hinz, Alexander; Schulz, Axel; Villinger, Alexander
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 7
• Pages of publication: 3692 - 3699
• a: 9.5435 ± 0.0004 Å
• b: 20.4621 ± 0.0007 Å
• c: 25.4288 ± 0.0009 Å
• α: 90°
• β: 99.148 ± 0.002°
• γ: 90°
• Cell volume: 4902.6 ± 0.3 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0568
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.0509
• Weighted residual factors for all reflections included in the refinement: 0.0566
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No