Information card for entry 7032780

Structure parameters

• Formula: C63.83 H47.83 Cl2.34 N7.83 O10 Zn
• Calculated formula: C63.832 H47.832 Cl2.336 N7.832 O10 Zn
• Title of publication: Synthesis, structure and photophysical properties of a highly luminescent terpyridine-diphenylacetylene hybrid fluorophore and its metal complexes.
• Authors of publication: Ghosh, Biswa Nath; Topić, Filip; Sahoo, Prasit Kumar; Mal, Prasenjit; Linnera, Jarno; Kalenius, Elina; Tuononen, Heikki M.; Rissanen, Kari
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 1
• Pages of publication: 254 - 267
• a: 9.065 ± 0.0003 Å
• b: 13.7517 ± 0.0007 Å
• c: 23.0439 ± 0.0009 Å
• α: 84.22 ± 0.004°
• β: 79.057 ± 0.003°
• γ: 87.837 ± 0.004°
• Cell volume: 2805.5 ± 0.2 ų
• Cell temperature: 123 ± 0.1 K
• Ambient diffraction temperature: 123 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.076
• Residual factor for significantly intense reflections: 0.0612
• Weighted residual factors for significantly intense reflections: 0.1667
• Weighted residual factors for all reflections included in the refinement: 0.1829
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No