Information card for entry 4313665

Structure parameters

• Common name: bis{diazamethylazoniaphosphaadamantane}tetraiodo ruthenium(II) dihydrate
• Chemical name: (OC-6-11)-{bis(3,5-diaza-1-methyl-1-azonia-7 -phosphatricyclo[3.3.1.1^3,7]decane}tetraiodoruthenium(II)-water (1/2)
• Formula: C14 H34 I4 N6 O2 P2 Ru
• Calculated formula: C14 H30 I4 N6 O4 P2 Ru
• SMILES: C1[N+]2(C)CN3C[P]1([Ru](I)(I)(I)(I)[P]14C[N+]5(C)CN(C1)CN(C4)C5)CN(C2)C3.O.O.O.O
• Title of publication: New Rhodium(III) and Ruthenium(II) Water-Soluble Complexes with 3,5-Diaza-1-methyl-1-azonia-7-phosphatricyclo[3.3.1.13,7]decane
• Authors of publication: Piotr Smoleński; Florian P. Pruchnik; Zbigniew Ciunik; Tadeusz Lis
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 3318 - 3322
• a: 8.041 ± 0.0016 Å
• b: 8.424 ± 0.0017 Å
• c: 10.87 ± 0.002 Å
• α: 106.77 ± 0.03°
• β: 94.71 ± 0.03°
• γ: 94.55 ± 0.03°
• Cell volume: 698.5 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0431
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.0942
• Weighted residual factors for all reflections included in the refinement: 0.0976
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No