Information card for entry 7721110

Structure parameters

• Formula: C18 H18 Br2 Cd2 N4 O10
• Calculated formula: C18 H18 Br2 Cd2 N4 O10
• Title of publication: A Ligand in the Metal Salt Sea: Extreme Metal-to-Ligand Ratios and the Thermodynamic Driving Force of the Halogen Bond
• Authors of publication: Yardan, Alper
• Journal of publication: Dalton Transactions
• Year of publication: 2026
• a: 11.111 ± 0.004 Å
• b: 10.209 ± 0.003 Å
• c: 7.45 ± 0.002 Å
• α: 89.93 ± 0.02°
• β: 93.63 ± 0.02°
• γ: 68.89 ± 0.03°
• Cell volume: 786.5 ± 0.5 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Goodness-of-fit parameter for all reflections: 1.47
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 1.5406 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No