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Information card for entry 2011837
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| Coordinates | 2011837.cif |
|---|---|
| Structure factors | 2011837.hkl |
| Original IUCr paper | HTML |
| Chemical name | 3-Phenylfuro[3,2-c]chromen-4-one |
|---|---|
| Formula | C17 H10 O3 |
| Calculated formula | C17 H10 O3 |
| SMILES | o1c2c(c3occ(c3c1=O)c1ccccc1)cccc2 |
| Title of publication | 3-Phenyl-4<i>H</i>-furo[3,2-<i>c</i>]chromen-4-one |
| Authors of publication | Bruno, Giuseppe; Nicoló, Francesco; Rotondo, Archimede; Foti, Francesco; Risitano, Francesco; Grassi, Giovanni; Bilardo, Cristina |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2001 |
| Journal volume | 57 |
| Journal issue | 4 |
| Pages of publication | 493 - 494 |
| a | 13.4239 ± 0.0011 Å |
| b | 7.2198 ± 0.0005 Å |
| c | 25.441 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2465.7 ± 0.4 Å3 |
| Cell temperature | 298 ± 2 K |
| Ambient diffraction temperature | 298 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.111 |
| Residual factor for significantly intense reflections | 0.052 |
| Weighted residual factors for all reflections included in the refinement | 0.123 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.98 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
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