Information card for entry 7245873

Structure parameters

• Formula: C20 H24 Mo N3 O5
• Calculated formula: C20 H24 Mo N3 O5
• SMILES: [Mo]12(OC(=N[N]2=Cc2c(O1)cc(N(CC)CC)cc2)c1cc(ccc1)C)(OC)(=O)=O
• Title of publication: Mo(vi) complexes of amide–imine conjugates for tuning the selectivity of fluorescence recognition of Y(iii) vs. Pb(ii)
• Authors of publication: Chatterjee, Sudeshna; Ta, Sabyasachi; Khanra, Somnath; Das, Debasis
• Journal of publication: RSC Advances
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 51
• Pages of publication: 33293 - 33303
• a: 13.7533 ± 0.0017 Å
• b: 20.0569 ± 0.001 Å
• c: 7.505 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2070.2 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.1107
• Residual factor for significantly intense reflections: 0.0843
• Weighted residual factors for significantly intense reflections: 0.2843
• Weighted residual factors for all reflections included in the refinement: 0.2984
• Goodness-of-fit parameter for all reflections included in the refinement: 1.28
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No