Information card for entry 7708206

Structure parameters

• Chemical name: tetra-(μ3-iodo)-tetrakis(10-(4-bromophenyl)-5,10-dihydro-5-methyl-phenarsazine)copper(I)
• Formula: C152 H120 As8 Br8 Cu8 I8 N8
• Calculated formula: C152 H120 As8 Br8 Cu8 I8 N8
• Title of publication: Luminescent Cu₄I₄-cubane clusters based on <i>N</i>-methyl-5,10-dihydrophenarsazines.
• Authors of publication: Galimova, Milyausha F.; Zueva, Ekaterina M.; Dobrynin, Alexey B.; Kolesnikov, Ilya E.; Musin, Rustem R.; Musina, Elvira I.; Karasik, Andrey A.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• a: 25.383 ± 0.002 Å
• b: 25.383 ± 0.002 Å
• c: 12.2628 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7900.9 ± 1.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 88
• Hermann-Mauguin space group symbol: I 41/a :2
• Hall space group symbol: -I 4ad
• Residual factor for all reflections: 0.0719
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1356
• Weighted residual factors for all reflections included in the refinement: 0.1617
• Goodness-of-fit parameter for all reflections included in the refinement: 0.995
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No