Information card for entry 1548829

Structure parameters

• Formula: C260 H338 Au42 S26
• Calculated formula: C260 H338 Au42 S26
• SMILES: [Au]1234567[Au]89%10%11%12[Au]%13%14%15%16%17%181[Au]1%19%20%21%22[Au]%23%24%252[Au]2%26%273[Au]348%131%23[Au]1%19([Au]49%14([Au]([S]1c1ccc(cc1)C(C)(C)C)[S]([Au]189%13%14[Au]%10%154[S]([Au]4[Au]%10%15%199([Au]9%23%28%29%30%311[Au]1%32%33%34%16%20[Au]%16%20%35%24[Au]%24%36%37%385[Au]56%11([Au]2([S]%12c2ccc(cc2)C(C)(C)C)[S]([Au]%26[S]%35c2ccc(cc2)C(C)(C)C)c2ccc(cc2)C(C)(C)C)[Au]7%178%1091%24[Au]126%23%32%16%36[Au]7%37([Au]89%101[Au]1%11%15%287[Au]7%19([Au]%12%15%29([Au]%13([S]7c7ccc(cc7)C(C)(C)C)[S]([Au]%18%21%14%33[Au]7%31%15([Au]%13%3021%12[Au]8([Au]1%34%2067[Au]([S]%25c2ccc(cc2)C(C)(C)C)[S]1c1ccc(cc1)C(C)(C)C)([S]%13c1ccc(cc1)C(C)(C)C)[S]([Au]9[S]%38c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)[S]([Au][S]%22c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)[S]([Au][S]([Au][S]%10c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)[S]%11c1ccc(cc1)C(C)(C)C)[S]([Au][S]5c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)[S]4c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)[S]([Au][S]([Au][S]%27c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C)[S]3c1ccc(cc1)C(C)(C)C
• Title of publication: Is the kernel-staples match a key-lock match?
• Authors of publication: Zhuang, Shengli; Liao, Lingwen; Zhao, Yan; Yuan, Jinyun; Yao, Chuanhao; Liu, Xu; Li, Jin; Deng, Haiteng; Yang, Jinlong; Wu, Zhikun
• Journal of publication: Chemical science
• Year of publication: 2018
• Journal volume: 9
• Journal issue: 9
• Pages of publication: 2437 - 2442
• a: 24.328 ± 0.002 Å
• b: 24.845 ± 0.003 Å
• c: 32.217 ± 0.003 Å
• α: 67.732 ± 0.003°
• β: 76.94 ± 0.002°
• γ: 84.496 ± 0.003°
• Cell volume: 17553 ± 3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1144
• Residual factor for significantly intense reflections: 0.0619
• Weighted residual factors for significantly intense reflections: 0.1493
• Weighted residual factors for all reflections included in the refinement: 0.1764
• Goodness-of-fit parameter for all reflections included in the refinement: 0.976
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No