Information card for entry 7210649

Structure parameters

• Formula: C20 H46 Ag2 Cu N8 O16
• Calculated formula: C20 H46 Ag2 Cu N8 O16
• SMILES: C1(=O)O[Ag]([NH2]CC[NH2][Ag]2[n]3c(C(=O)O2)c(ccc3)C(=O)[O-])[n]2c1c(ccc2)C(=O)[O-].C1[NH2][Cu]2([NH2]C1)[NH2]CC[NH2]2.O.O.O.O.O.O.O.O
• Title of publication: Construction of homo- and heterometallic-pyridine-2,3-dicarboxylate metallosupramolecular networks with structural diversity: 1D T5(2) water tape and unexpected coordination mode of pyridine-2,3-dicarboxylate
• Authors of publication: Semerci, Fatih; Yeşilel, Okan Zafer; Keskin, Seda; Darcan, Cihan; Taş, Murat; Dal, Hakan
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 6
• Pages of publication: 1244
• a: 23.396 ± 0.005 Å
• b: 6.654 ± 0.005 Å
• c: 23.775 ± 0.005 Å
• α: 90°
• β: 112.26 ± 0.03°
• γ: 90°
• Cell volume: 3425 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0983
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1701
• Weighted residual factors for all reflections included in the refinement: 0.2182
• Goodness-of-fit parameter for all reflections included in the refinement: 1.106
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No