Information card for entry 4305407

Structure parameters

• Formula: C6 H30 Ge2 N6 O6
• Calculated formula: C6 H30 Ge2 N6 O6
• SMILES: C1[NH2][Ge]23([NH2]CC[NH2]3)([NH2]CC[NH2]2)[NH2]C1.O[Ge](O)(O)(O)(O)O
• Title of publication: Two-Dimensional Hybrid Germanium Zeotype Formed by Selective Coordination of the trans-1,2-Diaminocyclohexane Isomer to the Ge Atom: Heterogeneous Acid-Base Bifunctional Catalyst
• Authors of publication: Felipe Gándara; Manuela E. Medina; Natalia Snejko; Berta Gómez-Lor; Marta Iglesias; Enrique Gutiérrez-Puebla; M. Angeles Monge
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 6791 - 6795
• a: 9.2324 ± 0.0007 Å
• b: 9.2324 ± 0.0007 Å
• c: 4.9209 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 363.25 ± 0.05 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 149
• Hermann-Mauguin space group symbol: P 3 1 2
• Hall space group symbol: P 3 2
• Residual factor for all reflections: 0.0697
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for significantly intense reflections: 0.1405
• Weighted residual factors for all reflections included in the refinement: 0.1456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.017
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No