Information card for entry 4323006

Structure parameters

• Chemical name: bis (/m-2,6-bis(diphenylphosphino)-pyridine-N,P)-tetrachloro-di-rhenium (II)
• Formula: C58 H46 Cl4 N2 P4 Re2
• Calculated formula: C58 H46 Cl4 N2 P4 Re2
• SMILES: [Re]123([Re]4(Cl)(Cl)([P](c5[n]3c([P]1(c1ccccc1)c1ccccc1)ccc5)(c1ccccc1)c1ccccc1)[P](c1[n]4c([P]2(c2ccccc2)c2ccccc2)ccc1)(c1ccccc1)c1ccccc1)(Cl)Cl
• Title of publication: Ligand Exchange or Reduction at Multiply Bonded Dimetal Units of Molybdenum and Rhenium by 2,6-Bis(diphenylphosphino)pyridine
• Authors of publication: F. Albert Cotton; Evgeny V. Dikarev; Glenn T. Jordan; Carlos A. Murillo; Marina A. Petrukhina
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 4611 - 4616
• a: 16.173 ± 0.002 Å
• b: 11.285 ± 0.001 Å
• c: 28.771 ± 0.004 Å
• α: 90°
• β: 96.17 ± 0.01°
• γ: 90°
• Cell volume: 5220.6 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• 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: 0.1072
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for all reflections: 0.0961
• Weighted residual factors for significantly intense reflections: 0.0766
• Goodness-of-fit parameter for all reflections: 1.054
• Goodness-of-fit parameter for significantly intense reflections: 1.122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No