Information card for entry 7015314

Structure parameters

• Formula: C127 H157 Cl6 F12 Fe2 N4 O21.5 P8 Pt4 S4
• Calculated formula: C127 H138 Cl6 F12 Fe2 N4 O21.5 P8 Pt4 S4
• Title of publication: Self-assembled molecular squares containing metal-based donor: synthesis and application in the sensing of nitro-aromatics.
• Authors of publication: Vajpayee, Vaishali; Kim, Hyunuk; Mishra, Anurag; Mukherjee, Partha Sarathi; Stang, Peter J.; Lee, Min Hyung; Kim, Hwan Kyu; Chi, Ki-Whan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 13
• Pages of publication: 3112 - 3115
• a: 13.851 ± 0.003 Å
• b: 22.464 ± 0.005 Å
• c: 51.056 ± 0.01 Å
• α: 90°
• β: 96.35 ± 0.03°
• γ: 90°
• Cell volume: 15789 ± 6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 10
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1474
• Residual factor for significantly intense reflections: 0.122
• Weighted residual factors for significantly intense reflections: 0.3434
• Weighted residual factors for all reflections included in the refinement: 0.3743
• Goodness-of-fit parameter for all reflections included in the refinement: 1.567
• Diffraction radiation wavelength: 0.9 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No