Information card for entry 4313525

Structure parameters

• Formula: C28 H41 Cl2 N7 Ni O14
• Calculated formula: C27.5 H37 Cl2 N7 Ni O14
• Title of publication: Aminomethyl-bipyridine Bearing Two Flexible Nitronyl-nitroxide Arms: A New Podand for Complexation of Transition Metals in a Facial or Meridional Conformation
• Authors of publication: Christophe Stroh; Elie Belorizky; Philippe Turek; Hélène Bolvin; Raymond Ziessel
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 2938 - 2949
• a: 15.2867 ± 0.0001 Å
• b: 15.2867 ± 0.0001 Å
• c: 13.716 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2775.78 ± 0.03 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Residual factor for all reflections: 0.068
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for all reflections: 0.185
• Weighted residual factors for all reflections included in the refinement: 0.075
• Goodness-of-fit parameter for all reflections: 3.472
• Goodness-of-fit parameter for all reflections included in the refinement: 1.416
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No