Information card for entry 1556522

Structure parameters

• Formula: C20 H19 Au Cl N3 O2
• Calculated formula: C20 H19 Au Cl N3 O2
• SMILES: [Au](Cl)=C1N(C=CN1C)c1ccc2c3c1cccc3C(=O)N(C2=O)CCCC
• Title of publication: N-Heterocyclic Carbene Coinage Metal Complexes Containing Naphthalimide Chromophore: Design, Structure, and Photophysical Properties
• Authors of publication: Lanoe, P.-H.; Najjari, B.; Hallez, F.; Gontard, G.; Amouri, H.
• Journal of publication: Inorganics
• Year of publication: 2017
• Journal volume: 5
• Pages of publication: 58
• a: 9.3874 ± 0.0002 Å
• b: 9.8339 ± 0.0002 Å
• c: 12.0913 ± 0.0002 Å
• α: 69.669 ± 0.001°
• β: 70.888 ± 0.001°
• γ: 76.465 ± 0.001°
• Cell volume: 979.82 ± 0.03 ų
• Cell temperature: 200 ± 1 K
• Ambient diffraction temperature: 200 ± 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: 0.024
• Residual factor for significantly intense reflections: 0.0209
• Weighted residual factors for significantly intense reflections: 0.0508
• Weighted residual factors for all reflections included in the refinement: 0.052
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No