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Information card for entry 1567691
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Coordinates | 1567691.cif |
---|---|
Original IUCr paper | HTML |
Common name | Bis(4-hydroxyphenyl) 1,4-phenylenebiscarbamate |
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Chemical name | 4-Hydroxyphenyl <i>N</i>-{4-[(4-hydroxyphenoxycarbonyl)amino]phenyl}carbamate |
Formula | C20 H16 N2 O6 |
Calculated formula | C20 H16 N2 O6 |
Title of publication | Bis(4-hydroxyphenyl) 1,4-phenylenebiscarbamate |
Authors of publication | Martínez-de la Luz, Isabel; López-Velázquez, Delia; Bernès, Sylvain; Varela Caselis, Jenaro L. |
Journal of publication | IUCrData |
Year of publication | 2022 |
Journal volume | 7 |
Journal issue | 9 |
Pages of publication | x220919 |
a | 19.0804 ± 0.0017 Å |
b | 4.6758 ± 0.0003 Å |
c | 10.1189 ± 0.0008 Å |
α | 90° |
β | 101.169 ± 0.007° |
γ | 90° |
Cell volume | 885.67 ± 0.12 Å3 |
Cell temperature | 295 ± 1 K |
Ambient diffraction temperature | 295 ± 1 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0855 |
Residual factor for significantly intense reflections | 0.0511 |
Weighted residual factors for significantly intense reflections | 0.1544 |
Weighted residual factors for all reflections included in the refinement | 0.1649 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.064 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.56083 Å |
Diffraction radiation type | AgKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1567691.html
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