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Information card for entry 4134637
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Coordinates | 4134637.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | PCN-224 |
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Chemical name | Hf-TBB |
Formula | C72.29 H39.16 Hf6.02 N6.02 O32.13 |
Calculated formula | C72 H45 Hf6 N6 O32 |
Title of publication | Nanoscale Metal-Organic Frameworks Stabilize Bacteriochlorins for Type I and Type II Photodynamic Therapy. |
Authors of publication | Luo, Taokun; Ni, Kaiyuan; Culbert, August; Lan, Guangxu; Li, Zhe; Jiang, Xiaomin; Kaufmann, Michael; Lin, Wenbin |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2020 |
Journal volume | 142 |
Journal issue | 16 |
Pages of publication | 7334 - 7339 |
a | 38.585 ± 0.01 Å |
b | 38.585 ± 0.01 Å |
c | 38.585 ± 0.01 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 57445 ± 3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 229 |
Hermann-Mauguin space group symbol | I m -3 m |
Hall space group symbol | -I 4 2 3 |
Residual factor for all reflections | 0.1085 |
Residual factor for significantly intense reflections | 0.1041 |
Weighted residual factors for significantly intense reflections | 0.2388 |
Weighted residual factors for all reflections included in the refinement | 0.2417 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.41328 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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