Information card for entry 7021599

Structure parameters

• Formula: C8 H24 Cu2 N16
• Calculated formula: C8 H24 Cu2 N16
• SMILES: C1C[N](C)(C)[Cu]2([NH2]1)([N](=N#N)[Cu]1([N](CC[NH2]1)(C)C)([N]2=N#N)N=N#N)N=N#N
• Title of publication: Discrete dinuclear complex to extended 2D compound in a Cu-azido system by controlling coligand stoichiometry: synthesis and magneto-structural correlations.
• Authors of publication: Chakraborty, Anindita; Srinivasa Rao, Lingampalli; Manna, Arun Kumar; Pati, Swapan K.; Ribas, Joan; Maji, Tapas Kumar
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 30
• Pages of publication: 10707 - 10714
• a: 9.3636 ± 0.0009 Å
• b: 10.7124 ± 0.0013 Å
• c: 9.6384 ± 0.001 Å
• α: 90°
• β: 104.864 ± 0.007°
• γ: 90°
• Cell volume: 934.44 ± 0.18 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1234
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.1081
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No