Information card for entry 2219340

Structure parameters

• Chemical name: μ-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^- bis(aqua(nitrato-κ<i>O</i>){[1-(2-pyridyl-κ<i>N</i>)ethylidene]hydrazine- κ<i>N</i>}copper(II))‒μ-oxalato- κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^- bis((methanol-κO)(nitrato-κ<i>O</i>){[1-(2-pyridyl- κ<i>N</i>)ethylidene]hydrazine-κ<i>N</i>}copper(II)) (1/1)
• Formula: C34 H48 Cu4 N16 O24
• Calculated formula: C34 H48 Cu4 N16 O24
• SMILES: c1cccc2C(=[N]([Cu]3([n]12)([O]=C1C(=[O][Cu]2(O1)([n]1ccccc1C(C)=[N]2N)(ON(=O)=O)[OH2])O3)(ON(=O)=O)[OH2])N)C.[n]12c(cccc2)C(=[N](N)[Cu]21([O]=C1C(O2)=[O][Cu]2([n]3ccccc3C(=[N]2N)C)(O1)([OH]C)ON(=O)=O)([OH]C)ON(=O)=O)C
• Title of publication: The cocrystal μ-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^-bis(aqua(nitrato-κ<i>O</i>){[1-(2-pyridyl-κ<i>N</i>)ethylidene]hydrazine-κ<i>N</i>}copper(II)) μ-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^-bis((methanol-κ<i>O</i>)(nitrato-κ<i>O</i>){[1-(2-pyridyl-κ<i>N</i>)ethylidene]hydrazine-κ<i>N</i>}copper(II)) (1/1)
• Authors of publication: Diallo, Madina; Tamboura, Farba Bouyagui; Gaye, Mohamed; Barry, Aliou Hamady; Bah, Youssouph
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 9
• Pages of publication: m1124 - m1125
• a: 9.8358 ± 0.0009 Å
• b: 12.3773 ± 0.001 Å
• c: 12.7136 ± 0.001 Å
• α: 103.704 ± 0.004°
• β: 112.573 ± 0.004°
• γ: 107.821 ± 0.004°
• Cell volume: 1245.2 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0882
• Residual factor for significantly intense reflections: 0.0589
• Weighted residual factors for significantly intense reflections: 0.1047
• Weighted residual factors for all reflections included in the refinement: 0.1122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes