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Information card for entry 1571705
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Coordinates | 1571705.cif |
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Original paper (by DOI) | HTML |
Chemical name | 4-aminophenylalanine |
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Formula | C18 H30 N4 O7 |
Calculated formula | C18 H30 N4 O7 |
Title of publication | Probing assembly/disassembly of ordered molecular hydrogels |
Authors of publication | Ramalhete, Susana; Green, Hayley; Angulo, Jesús; Iuga, Dinu; Fábián, László; Lloyd, Gareth O.; Khimyak, Yaroslav Z. |
Journal of publication | Faraday Discussions |
Year of publication | 2024 |
a | 5.9813 ± 0.0009 Å |
b | 11.3702 ± 0.0015 Å |
c | 14.985 ± 0.002 Å |
α | 90° |
β | 93.681 ± 0.008° |
γ | 90° |
Cell volume | 1017 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100.15 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.069 |
Residual factor for significantly intense reflections | 0.0573 |
Weighted residual factors for significantly intense reflections | 0.1576 |
Weighted residual factors for all reflections included in the refinement | 0.1654 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.086 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
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292010 (current) | 2024-05-24 | cif/ Adding structures of 1571705 via cif-deposit CGI script. |
1571705.cif |
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