Information card for entry 8106985

Structure parameters

• Formula: C52 H40 Cl4 N4 O12 Sr2
• Calculated formula: C52 H40 Cl4 N4 O12 Sr2
• Title of publication: Crystal structure of tetraaquabis(μ2-4-chlorobenzoato-κ2 O:O,O′)bis(4-chlorobenzoato-κO)bis(1,10-phenanthroline-κ2 N,N′)distrontium(II), C52H40Cl4N4O12Sr2
• Authors of publication: Hu, Ling-Xia; Zhang, Bi-Song; Qiu, Jing-Ping; Wu, Chang-Sheng; Liu, Zhen-Xiang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 3
• Pages of publication: 715 - 717
• a: 8.9531 ± 0.0018 Å
• b: 9.0657 ± 0.0018 Å
• c: 16.911 ± 0.003 Å
• α: 75.56 ± 0.03°
• β: 81.96 ± 0.03°
• γ: 73.84 ± 0.03°
• Cell volume: 1273 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0464
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0716
• Weighted residual factors for all reflections included in the refinement: 0.076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No