Information card for entry 7003313

Structure parameters

• Formula: C16 H13 Co1.5 N5 O5
• Calculated formula: C16 H13 Co1.5 N5 O5
• Title of publication: Assembling metals (CoII and MnII) with pyridylcarboxylates in the presence of azide: synthesis, structural aspects and magnetic behavior of three coordination polymers
• Authors of publication: Mondal, Kartik Chandra; Sengupta, Oindrila; Nethaji, Munirathinam; Mukherjee, Partha Sarathi
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 6
• Pages of publication: 767 - 775
• a: 6.716 ± 0.004 Å
• b: 11.927 ± 0.006 Å
• c: 13.137 ± 0.007 Å
• α: 82.911 ± 0.01°
• β: 83.696 ± 0.009°
• γ: 87.902 ± 0.01°
• Cell volume: 1037.7 ± 1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1524
• Residual factor for significantly intense reflections: 0.11
• Weighted residual factors for significantly intense reflections: 0.3304
• Weighted residual factors for all reflections included in the refinement: 0.3502
• Goodness-of-fit parameter for all reflections included in the refinement: 1.211
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No