Information card for entry 7250978

Structure parameters

• Formula: C95.6 H127.6 Cu4 N8
• Calculated formula: C92 H124 Cu4 N8
• 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: 15.8447 ± 0.0005 Å
• b: 16.6587 ± 0.0005 Å
• c: 17.2643 ± 0.0005 Å
• α: 73.325 ± 0.001°
• β: 80.088 ± 0.002°
• γ: 68.762 ± 0.001°
• Cell volume: 4057 ± 0.2 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0465
• Residual factor for significantly intense reflections: 0.0382
• Weighted residual factors for significantly intense reflections: 0.0951
• Weighted residual factors for all reflections included in the refinement: 0.0994
• 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