Information card for entry 4337851

Structure parameters

• Formula: C124 H108 Au10 Cl2 N4 O8 P8 S4
• Calculated formula: C124 H108 Au10 N4 P8 S4
• SMILES: c1(ccc(cc1)C)N1[P](c2ccccc2)([Au][S]2[Au][P](N(c3ccc(cc3)C)[P](c3ccccc3)([Au][S]3[Au][P](N(c4ccc(cc4)C)[P](c4ccccc4)([Au][S]([Au][P](N(c4ccc(cc4)C)[P](c4ccccc4)([Au][S]([Au][P]1(c1ccccc1)c1ccccc1)[Au]3)c1ccccc1)(c1ccccc1)c1ccccc1)[Au]2)c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: Synthesis, Characterization, and Luminescence Studies of Discrete Polynuclear Gold(I) Sulfido and Selenido Complexes with Intramolecular Aurophilic Contacts.
• Authors of publication: Cheng, Eddie Chung-Chin; Lo, Wing-Yin; Lee, Terence Kwok-Ming; Zhu, Nianyong; Yam, Vivian Wing-Wah
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 3854
• a: 19.449 ± 0.002 Å
• b: 19.449 ± 0.002 Å
• c: 20.958 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7927.6 ± 1.4 ų
• Cell temperature: 301 ± 2 K
• Ambient diffraction temperature: 301 ± 2 K
• Number of distinct elements: 8
• Space group number: 114
• Hermann-Mauguin space group symbol: P -4 21 c
• Hall space group symbol: P -4 2n
• Residual factor for all reflections: 0.0594
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.1384
• Weighted residual factors for all reflections included in the refinement: 0.1525
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No