Information card for entry 4349415

Structure parameters

• Formula: C174.85 H155.19 B3 Cl1.69 F24 N12 O18.25 P6 Pd3 S6
• Calculated formula: C174.846 H154.691 B3 Cl1.6914 F24 N12 O18.25 P6 Pd3 S6
• Title of publication: Self-Assembled Novel BODIPY-Based Palladium Supramolecules and Their Cellular Localization.
• Authors of publication: Gupta, Gajendra; Das, Abhishek; Park, Kyoung Chul; Tron, Artur; Kim, Hyunuk; Mun, Junyoung; Mandal, Nripendranath; Chi, Ki-Whan; Lee, Chang Yeon
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 8
• Pages of publication: 4616 - 4622
• a: 27.571 ± 0.006 Å
• b: 31.893 ± 0.006 Å
• c: 34.388 ± 0.007 Å
• α: 110.88 ± 0.03°
• β: 113.19 ± 0.03°
• γ: 91.32 ± 0.03°
• Cell volume: 25495 ± 13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 10
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1476
• Residual factor for significantly intense reflections: 0.1333
• Weighted residual factors for significantly intense reflections: 0.3925
• Weighted residual factors for all reflections included in the refinement: 0.4139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.809
• Diffraction radiation wavelength: 0.7 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No