Information card for entry 1547199

Structure parameters

• Formula: C22 H16 O2
• Calculated formula: C22 H16 O2
• SMILES: c12ccc(c3ccc4c(c(cc1)ccc4)c23)C=C(C(=O)C)C(=O)C
• Title of publication: Highly Selective Sub-ppm Naked-Eye Detection of Hydrazine with Conjugated-1,3-Diketo Probes: Imaging Hydrazine in Drosophila Larvae.
• Authors of publication: Roy, Biswajit; Halder, Sudipta; Guha, Abhishek; Bandyopadhyay, Subhajit
• Journal of publication: Analytical chemistry
• Year of publication: 2017
• Journal volume: 89
• Journal issue: 19
• Pages of publication: 10625 - 10636
• a: 14.1242 ± 0.0011 Å
• b: 7.793 ± 0.0005 Å
• c: 14.2055 ± 0.001 Å
• α: 90°
• β: 100.715 ± 0.008°
• γ: 90°
• Cell volume: 1536.34 ± 0.19 ų
• Cell temperature: 99.99 ± 0.1 K
• Ambient diffraction temperature: 99.99 ± 0.1 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.058
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.1178
• Weighted residual factors for all reflections included in the refinement: 0.1258
• Goodness-of-fit parameter for all reflections included in the refinement: 1.081
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No