Information card for entry 1571590

Structure parameters

• Formula: C235 H212 Ag12 Au30
• Calculated formula: C235 H211.5 Ag12 Au30
• SMILES: [Au]123[Au]4([Au]51[Au]2([Au]([C](#Cc1ccc(cc1C)C)[Au])C#[C]([Au])c1ccc(cc1C)C)[Au]1([Ag]5[C](#Cc2ccc(cc2C)C)[Au]2[Au][Au]([C](#Cc5ccc(cc5C)C)[Ag]3[Au]4([C](#Cc3ccc(cc3C)C)[Ag][C]2#Cc2ccc(cc2C)C)[C](#Cc2ccc(cc2C)C)[Ag])[C](#Cc2ccc(cc2C)C)[Ag][C]1#Cc1ccc(cc1C)C)[C](#Cc1ccc(cc1C)C)[Ag])[Au]([Ag][C](#Cc1ccc(cc1C)C)[Au]([Au]([Au]1[Au]2[Au]([Au](C#[C]([Au])c3ccc(cc3C)C)[C](#Cc3ccc(cc3C)C)[Au])[Au]([C](#Cc3ccc(cc3C)C)[Ag])[C](#Cc3ccc(cc3C)C)[Ag][C]([Au]([Au]12)[C](#Cc1ccc(cc1C)C)[Ag])#Cc1ccc(cc1C)C)[Au]([C]([Au])#Cc1ccc(cc1C)C)[C](#Cc1ccc(cc1C)C)[Au])[C](#Cc1ccc(cc1C)C)[Ag][C](#Cc1ccc(cc1C)C)[Au][C](#Cc1ccc(cc1C)C)[Ag])(C#[C]([Au])c1ccc(cc1C)C)[C](#Cc1ccc(cc1C)C)[Au]
• Title of publication: Diachronic evolvement from tetra-icosahedral to quasi-hexagonal close-packed bimetal clusters.
• Authors of publication: Tang, Shisi; Wang, Endong; Wu, Yanzhen; Song, Tongxin; Zhou, Meng; Cai, Xiao; Gao, Yi; Ding, Weiping; Zhu, Yan
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 22
• Pages of publication: 8372 - 8379
• a: 21.3484 ± 0.0014 Å
• b: 29.2299 ± 0.0019 Å
• c: 40.094 ± 0.003 Å
• α: 79.787 ± 0.001°
• β: 75.632 ± 0.001°
• γ: 89.066 ± 0.001°
• Cell volume: 23842 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.1451
• Residual factor for significantly intense reflections: 0.0809
• Weighted residual factors for significantly intense reflections: 0.201
• Weighted residual factors for all reflections included in the refinement: 0.265
• Goodness-of-fit parameter for all reflections included in the refinement: 1.19
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No