Information card for entry 4319358

Structure parameters

• Common name: Bis([2.2.2]-cryptand) Platinum-bis(maleonitrilediselenolate)
• Formula: C44 H72 K2 N8 O12 Pt Se4
• Calculated formula: C44 H72 K2 N8 O12 Pt Se4
• SMILES: [K]1234567[O]8CC[O]1CC[N]21CC[O]3CC[O]4CC[N]5(CC8)CC[O]6CC[O]7CC1.[Pt]12([Se]C(=C(C#N)[Se]1)C#N)[Se]C(=C(C#N)[Se]2)C#N.[K]1234567[O]8CC[O]1CC[N]21CC[O]3CC[O]4CC[N]5(CC8)CC[O]6CC[O]7CC1
• Title of publication: Syntheses and Characterization of the Metal Maleonitrilediselenolates [K([2.2.2]-cryptand)]2[M(Se2C2(CN)2)2] (M = Ni, Pd, Pt) and [Ni(dmf)5Cl]2[Ni(Se2C2(CN)2)2]
• Authors of publication: Craig C. McLauchlan; Scott D. Robowski; James A. Ibers
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 1372 - 1375
• a: 12.292 ± 0.003 Å
• b: 15.671 ± 0.003 Å
• c: 15.569 ± 0.003 Å
• α: 90°
• β: 108.59 ± 0.03°
• γ: 90°
• Cell volume: 2842.5 ± 1.2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0557
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0813
• Weighted residual factors for all reflections included in the refinement: 0.084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.324
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No