Information card for entry 4343377

Structure parameters

• Formula: C21 H20 N2 O2
• Calculated formula: C21 H20 N2 O2
• SMILES: C1(=O)c2c3c(C(=O)N1CC#C)cccc3c(cc2)N1CCC(CC1)C
• Title of publication: Alkynyl-naphthalimide Fluorophores: Gold Coordination Chemistry and Cellular Imaging Applications.
• Authors of publication: Langdon-Jones, Emily E; Lloyd, David; Hayes, Anthony J.; Wainwright, Shane D.; Mottram, Huw J.; Coles, Simon J.; Horton, Peter N.; Pope, Simon J. A.
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 13
• Pages of publication: 6606 - 6615
• a: 9.5575 ± 0.0007 Å
• b: 10.854 ± 0.0008 Å
• c: 16.2316 ± 0.0011 Å
• α: 90°
• β: 91.46 ± 0.002°
• γ: 90°
• Cell volume: 1683.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0672
• Residual factor for significantly intense reflections: 0.0588
• Weighted residual factors for significantly intense reflections: 0.1664
• Weighted residual factors for all reflections included in the refinement: 0.1743
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No