Information card for entry 4301834

Structure parameters

• Common name: [Mg(DPP)(DBP)(H-TMG)]2 (4)
• Formula: C62 H88 Mg2 N6 O10 P2
• Calculated formula: C62 H88 Mg2 N6 O10 P2
• SMILES: C(=[NH]\[Mg]1([O]=P(O[Mg](/[NH]=C(N(C)C)/N(C)C)(Oc2c(cccc2C(C)(C)C)C(C)(C)C)[O]=P(O1)(Oc1ccccc1)Oc1ccccc1)(Oc1ccccc1)Oc1ccccc1)Oc1c(C(C)(C)C)cccc1C(C)(C)C)(N(C)C)/N(C)C
• Title of publication: Structurally Characterized 1,1,3,3-Tetramethylguanidine Solvated Magnesium Aryloxide Complexes: [Mg(μ-OEt)(DBP)(H-TMG)]2, [Mg(μ-OBc)(DBP)(H-TMG)]2, [Mg(μ-TMBA)(DBP)(H-TMG)]2, [Mg(μ-DPP)(DBP)(H-TMG)]2, [Mg(BMP)2(H-TMG)2], [Mg(O-2,6-Ph2C6H3)2(H-TMG)2]
• Authors of publication: Jessie D. Monegan; Scott D. Bunge
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 3248 - 3256
• a: 15.1 ± 0.003 Å
• b: 11.26 ± 0.002 Å
• c: 19.34 ± 0.004 Å
• α: 90°
• β: 93.6 ± 0.03°
• γ: 90°
• Cell volume: 3281.8 ± 1.1 ų
• Cell temperature: 160 ± 2 K
• Ambient diffraction temperature: 160 ± 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: 0.0435
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.1235
• Weighted residual factors for all reflections included in the refinement: 0.1341
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No