Information card for entry 4076662

Structure parameters

• Formula: C26 H54 B F4 N O2 Os P2
• Calculated formula: C26 H54 B F4 N O2 Os P2
• SMILES: [OsH2]1([P](C(C)C)(C(C)C)C(C)C)([P](C(C)C)(C(C)C)C(C)C)([O]=C(O1)C)[NH2]c1ccccc1.[B](F)(F)(F)[F-]
• Title of publication: Dihydride versus Elongated Dihydrogen in [H2Os(κ2-O2CCH3)L(PiPr3)2]+Complexes: Influence of the L Ligand
• Authors of publication: Esteruelas, Miguel A.; García-Yebra, Cristina; Oliván, Montserrat; Oñate, Enrique; Tajada, María A.
• Journal of publication: Organometallics
• Year of publication: 2002
• Journal volume: 21
• Journal issue: 6
• Pages of publication: 1311
• a: 10.5133 ± 0.001 Å
• b: 11.344 ± 0.001 Å
• c: 15.0795 ± 0.0014 Å
• α: 94.795 ± 0.002°
• β: 99.201 ± 0.002°
• γ: 114.106 ± 0.001°
• Cell volume: 1598.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0479
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.0668
• Goodness-of-fit parameter for all reflections included in the refinement: 0.879
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No