Information card for entry 2016300

Structure parameters

• Chemical name: diaquabis(2-hydroxybenzoato-κ<i>O</i>)bis(1,10-phenanthroline-\ κ^2^<i>N</i>,<i>N</i>')strontium(II)
• Formula: C38 H30 N4 O8 Sr
• Calculated formula: C38 H30 N4 O8 Sr
• Title of publication: Intramolecular π‒π stacking in diaquabis(2-hydroxybenzoato-κ<i>O</i>)bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')strontium(II)
• Authors of publication: Duan-Jun Xu; Bing-Yu Zhang; Jian-Rong Su; Jing-Jing Nie
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: m622 - m624
• a: 23.411 ± 0.004 Å
• b: 10.409 ± 0.002 Å
• c: 13.722 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3343.8 ± 1.1 ų
• Cell temperature: 295 ± 3 K
• Ambient diffraction temperature: 295 ± 3 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.104
• Weighted residual factors for all reflections included in the refinement: 0.113
• Goodness-of-fit parameter for all reflections included in the refinement: 1.179
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes