Information card for entry 1568442

Structure parameters

• Formula: C19 H19 Br N P
• Calculated formula: C19 H19 Br N P
• Title of publication: Beyond the TPP⁺ "gold standard": a new generation mitochondrial delivery vector based on extended PN frameworks.
• Authors of publication: Ong, How Chee; Coimbra, João T S; Ramos, Maria J.; Xing, Bengang; Fernandes, Pedro A.; García, Felipe
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 15
• Pages of publication: 4126 - 4133
• a: 9.4139 ± 0.0004 Å
• b: 9.7021 ± 0.0004 Å
• c: 10.4201 ± 0.0004 Å
• α: 63.457 ± 0.001°
• β: 80.694 ± 0.002°
• γ: 85.381 ± 0.001°
• Cell volume: 840.16 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1153
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.0857
• Weighted residual factors for all reflections included in the refinement: 0.1048
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No