Information card for entry 7157783

Structure parameters

• Common name: 18087z
• Formula: C25 H29 N O7
• Calculated formula: C25 H29 N O7
• SMILES: o1c2ccc(cc2c2ccc(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)cc12)CC(=O)OC
• Title of publication: Two-photon uncaging of bioactive thiols in live cells at wavelengths above 800 nm.
• Authors of publication: Hammers, Matthew D.; Hodny, Michael H.; Bader, Taysir K.; Mahmoodi, M. Mohsen; Fang, Sifei; Fenton, Alexander D.; Nurie, Kadiro; Trial, Hallie O.; Xu, Feng; Healy, Andrew T.; Ball, Zachary T.; Blank, David A.; Distefano, Mark D.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2021
• Journal volume: 19
• Journal issue: 10
• Pages of publication: 2213 - 2223
• a: 5.6978 ± 0.0007 Å
• b: 24.596 ± 0.003 Å
• c: 16.9362 ± 0.0018 Å
• α: 90°
• β: 94.356 ± 0.004°
• γ: 90°
• Cell volume: 2366.6 ± 0.5 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0677
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1366
• Weighted residual factors for all reflections included in the refinement: 0.1467
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No