Information card for entry 4319105

Structure parameters

• Formula: C26 H28 Cu2 N6 Nd1.33 O20
• Calculated formula: C26 Cu2 N6 Nd1.33333 O20
• Title of publication: A NdIIICuII Molecular Material with a Honeycomb-like Structure
• Authors of publication: Carole Daiguebonne; Olivier Guillou; Myrtil L. Kahn; Olivier Kahn; Robert L. Oushoorn; Kamal Boubekeur
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 176 - 178
• a: 16.3144 ± 0.0012 Å
• b: 16.3144 ± 0.0012 Å
• c: 52.47 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 12094.4 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 146
• Hermann-Mauguin space group symbol: R 3 :H
• Hall space group symbol: R 3
• Residual factor for all reflections: 0.3178
• Residual factor for significantly intense reflections: 0.079
• Weighted residual factors for all reflections: 0.2976
• Weighted residual factors for significantly intense reflections: 0.1776
• Goodness-of-fit parameter for all reflections: 0.793
• Goodness-of-fit parameter for significantly intense reflections: 1.172
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No