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Information card for entry 7232812
Preview
Coordinates | 7232812.cif |
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Original paper (by DOI) | HTML |
Chemical name | 3,3',6,6'-tetramethoxy-[9,9'-bianthracene]-10,10'(9H,9'H)-dione |
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Formula | C32 H26 O6 |
Calculated formula | C32 H26 O6 |
Title of publication | Solvent Viscosity-Dependent Isomerization Equilibrium of Tetramethoxy-Substituted Bianthrone |
Authors of publication | Hirao, Yasukazu; Hamamoto, Yosuke; Nagamachi, Nobuhiro; Kubo, Takashi |
Journal of publication | Physical Chemistry Chemical Physics |
Year of publication | 2019 |
a | 25.4848 ± 0.0018 Å |
b | 7.819 ± 0.0006 Å |
c | 13.9952 ± 0.0011 Å |
α | 90° |
β | 92.559 ± 0.007° |
γ | 90° |
Cell volume | 2786 ± 0.4 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 3 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.0595 |
Residual factor for significantly intense reflections | 0.0454 |
Weighted residual factors for significantly intense reflections | 0.1725 |
Weighted residual factors for all reflections included in the refinement | 0.195 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.808 |
Diffraction radiation wavelength | 0.71075 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
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215437 (current) | 2019-05-23 | cif/ Adding structures of 7232811, 7232812 via cif-deposit CGI script. |
7232812.cif |
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