Information card for entry 7037785

Structure parameters

• Formula: C18 H13 N3 O3
• Calculated formula: C18 H13 N3 O3
• SMILES: Oc1c(/C=N/N=C/c2ccc(N(=O)=O)cc2)c2c(cc1)cccc2
• Title of publication: Dual mode ratiometric recognition of zinc acetate: nanomolar detection with in vitro tracking of endophytic bacteria in rice root tissue.
• Authors of publication: Ghosh, Abhijit; Ta, Sabyasachi; Ghosh, Milan; Karmakar, Subhajit; Banik, Avishek; Dangar, Tushar Kanti; Mukhopadhyay, Subhra Kanti; Das, Debasis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 45
• Journal issue: 2
• Pages of publication: 599 - 606
• a: 7.2028 ± 0.0003 Å
• b: 7.9197 ± 0.0003 Å
• c: 14.7696 ± 0.0006 Å
• α: 81.753 ± 0.003°
• β: 84.845 ± 0.002°
• γ: 65.428 ± 0.002°
• Cell volume: 757.87 ± 0.05 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0806
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.13
• Weighted residual factors for all reflections included in the refinement: 0.1547
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No