Information card for entry 4311002

Structure parameters

• Formula: C38.25 H36 B N6 O3 Zn
• Calculated formula: C37 H0.6665 B N6 O3 Zn
• Title of publication: Using Model Complexes To Augment and Advance Metalloproteinase Inhibitor Design
• Authors of publication: Faith E. Jacobsen; Seth M. Cohen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 3038 - 3047
• a: 11.3476 ± 0.0008 Å
• b: 17.3815 ± 0.0013 Å
• c: 17.7829 ± 0.0013 Å
• α: 90.55 ± 0.001°
• β: 103.822 ± 0.001°
• γ: 95.085 ± 0.001°
• Cell volume: 3390.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0751
• Residual factor for significantly intense reflections: 0.0648
• Weighted residual factors for significantly intense reflections: 0.2236
• Weighted residual factors for all reflections included in the refinement: 0.2297
• Goodness-of-fit parameter for all reflections included in the refinement: 1.305
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No