Information card for entry 7134712

Structure parameters

• Formula: C15 H52 B40 Cu4 S4
• Calculated formula: C15 H52 B40 Cu4 S4
• Title of publication: Mechanochromic luminescence in copper nanoclusters: resolving structural transitions through microcrystal electron diffraction.
• Authors of publication: Nagar, Harshita; Duary, Subrata; Yadav, Vivek; Kini, Amoghavarsha Ramachandra; Antharjanam, Sudhadevi; Base, Tomas; Som, Anirban; Nannenga, Brent L.; Pradeep, Thalappil
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2025
• Journal volume: 61
• Journal issue: 58
• Pages of publication: 10764 - 10767
• a: 12.25 ± 0.002 Å
• b: 13.32 ± 0.003 Å
• c: 16.05 ± 0.003 Å
• α: 97.18 ± 0.03°
• β: 110.76 ± 0.03°
• γ: 99.99 ± 0.03°
• Cell volume: 2361.8 ± 1 ų
• Cell temperature: 77 ± 2 K
• Ambient diffraction temperature: 77 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2457
• Residual factor for significantly intense reflections: 0.172
• Weighted residual factors for significantly intense reflections: 0.4196
• Weighted residual factors for all reflections included in the refinement: 0.459
• Goodness-of-fit parameter for all reflections included in the refinement: 1.522
• Diffraction radiation wavelength: 0.0197 Å
• Diffraction radiation type: 300KeVELECTRONS
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No