Information card for entry 7250977

Structure parameters

• Formula: C48 H69 Ag3 N6
• Calculated formula: C48 H69 Ag3 N6
• Title of publication: Multinuclear copper(i) and silver(i) pyrazolates decorated with adamantyl substituents
• Authors of publication: Phan, Vo Quang Huy; Watson, Brandon T.; Noonikara-Poyil, Anurag; Duran, Katrina; Patterson, Monika R.; Dias, H. V. Rasika
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 43
• Pages of publication: 6987 - 6999
• a: 14.9738 ± 0.0017 Å
• b: 12.7162 ± 0.0015 Å
• c: 23.893 ± 0.003 Å
• α: 90°
• β: 95.89 ± 0.002°
• γ: 90°
• Cell volume: 4525.4 ± 0.9 ų
• Cell temperature: 99.98 K
• Ambient diffraction temperature: 99.98 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0405
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.0725
• Weighted residual factors for all reflections included in the refinement: 0.0773
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No