Information card for entry 4074586

Structure parameters

• Formula: C22 H44 N4 O P2 Pt
• Calculated formula: C22 H44 N4 O P2 Pt
• SMILES: c1(ncc[nH]1)[P](C(C)(C)C)(C(C)(C)C)[PtH](O)[P](c1[nH]ccn1)(C(C)(C)C)C(C)(C)C
• Title of publication: Bifunctional Imidazolylphosphine Ligands as Hydrogen Bond Donors Promote N−H and O−H Activation on Platinum
• Authors of publication: Grotjahn, Douglas B.; Gong, Yi; DiPasquale, Antonio G.; Zakharov, Lev N.; Rheingold, Arnold L.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 24
• Pages of publication: 5693
• a: 15.938 ± 0.002 Å
• b: 11.065 ± 0.0015 Å
• c: 16.233 ± 0.002 Å
• α: 90°
• β: 110.883 ± 0.002°
• γ: 90°
• Cell volume: 2674.7 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0273
• Residual factor for significantly intense reflections: 0.0245
• Weighted residual factors for significantly intense reflections: 0.0531
• Weighted residual factors for all reflections included in the refinement: 0.0547
• Goodness-of-fit parameter for all reflections included in the refinement: 0.836
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No