Information card for entry 8102663

Structure parameters

• Chemical name: diaqua-bis((4,4'-azopyridine)-(2,3-Naphthalenedicarboxylic acid))zinc(II)], Zn(C~12~H~7~O~4~)~2~(C~10~N~4~H~8~)~2~(H~2~O)~2~
• Formula: C44 H34 N8 O10 Zn
• Calculated formula: C44 H34 N8 O10 Zn
• Title of publication: Crystal structure of diaquabis[(4,4'-azopyridine)-(hydrogen 2,3-naphthalenedicarboxylato))zinc(II)], Zn(H2O)2(C10N4H8)2(C12H7O4)2
• Authors of publication: Min Hu; Rui Wang
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 2
• Pages of publication: 265
• a: 7.1739 ± 0.0005 Å
• b: 10.1771 ± 0.0006 Å
• c: 13.5367 ± 0.0009 Å
• α: 91.624 ± 0.005°
• β: 94.07 ± 0.005°
• γ: 94.618 ± 0.005°
• Cell volume: 982.04 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0726
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.0786
• Weighted residual factors for all reflections included in the refinement: 0.0815
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No