Information card for entry 7116184

Structure parameters

• Formula: C111 H110 F6 Mn2 N5 O10 P4 S2
• Calculated formula: C112 H82 F6 Mn2 N5 O10 P4 S2
• Title of publication: A photoCORM nanocarrier for CO release using NIR light.
• Authors of publication: Pierri, Agustin E.; Huang, Po-Ju; Garcia, John V.; Stanfill, James G.; Chui, Megan; Wu, Guang; Zheng, Nanfeng; Ford, Peter C.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2015
• Journal volume: 51
• Journal issue: 11
• Pages of publication: 2072 - 2075
• a: 12.451 ± 0.002 Å
• b: 27.816 ± 0.004 Å
• c: 14.753 ± 0.002 Å
• α: 90°
• β: 105.155 ± 0.004°
• γ: 90°
• Cell volume: 4931.8 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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: 0.0817
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1165
• Weighted residual factors for all reflections included in the refinement: 0.1254
• Goodness-of-fit parameter for all reflections included in the refinement: 1.164
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No