Information card for entry 7023932

Structure parameters

• Formula: C16 H20 Mn N6 O8
• Calculated formula: C16 H20 Mn N6 O8
• SMILES: c1(ccc2c3c(n[nH]c2=O)O[Mn]2([n]13)([n]1c(ccc3c1c(O2)n[nH]c3=O)C)([OH2])[OH2])C.O.O
• Title of publication: Synthesis, structural characterization and photoluminescence property of three Zn(2+)/Mn(2+)-acylhydrazidate complexes and two acylhydrazide molecules.
• Authors of publication: Wang, Yan-Ning; Bai, Fu-Quan; Yu, Jie-Hui; Xu, Ji-Qing
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 47
• Pages of publication: 16547 - 16555
• a: 7.6372 ± 0.0004 Å
• b: 7.785 ± 0.0005 Å
• c: 8.9475 ± 0.0007 Å
• α: 83.833 ± 0.004°
• β: 71.494 ± 0.004°
• γ: 67.412 ± 0.004°
• Cell volume: 465.71 ± 0.06 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: 0.0343
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0922
• Weighted residual factors for all reflections included in the refinement: 0.0949
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No