Information card for entry 7012932

Structure parameters

• Common name: [Zn(NO3)2(4,7-phen)(H2O)].MeCN
• Chemical name: Zinc(II)-(4,7-phenanthroline)-bis-nitrate hydrate.acetonitrile
• Formula: C14 H13 N5 O7 Zn
• Calculated formula: C14 H13 N5 O7 Zn
• Title of publication: The r�le of 4,7-phenanthroline in coordination polymer construction
• Authors of publication: Barnett, Sarah A.; Blake, Alexander J.; Champness, Neil R.; Wilson, Claire
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 12
• Pages of publication: 2387
• a: 22.3308 ± 0.0011 Å
• b: 7.8991 ± 0.0004 Å
• c: 18.5781 ± 0.0009 Å
• α: 90°
• β: 96.296 ± 0.001°
• γ: 90°
• Cell volume: 3257.3 ± 0.3 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0536
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0912
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No