Information card for entry 7250974

Structure parameters

• Formula: C67 H95 Cl9 Cu4 N8
• Calculated formula: C67 H95 Cl9 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: 11.7131 ± 0.0015 Å
• b: 12.9283 ± 0.0016 Å
• c: 23.679 ± 0.003 Å
• α: 81.723 ± 0.002°
• β: 86.491 ± 0.002°
• γ: 89.546 ± 0.002°
• Cell volume: 3541.7 ± 0.8 ų
• Cell temperature: 100.03 K
• Ambient diffraction temperature: 100.03 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: 0.0576
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.1109
• Weighted residual factors for all reflections included in the refinement: 0.1181
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• 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