Information card for entry 7038529

Structure parameters

• Formula: C26 H22 N5 Nd O8
• Calculated formula: C26 H22 N5 Nd O8
• SMILES: [Nd]12345(ON(=[O]2)=O)([O]=C(C)C=C(O1)C)([n]1c(c2[n]5cccc2)cc(c2ccccc2)cc1c1[n]3cccc1)ON(=[O]4)=O
• Title of publication: Mitochondrial selectivity and remarkable photocytotoxicity of a ferrocenyl neodymium(iii) complex of terpyridine and curcumin in cancer cells.
• Authors of publication: Sarkar, Tukki; Banerjee, Samya; Mukherjee, Sanjoy; Hussain, Akhtar
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 15
• Pages of publication: 6424 - 6438
• a: 9.5473 ± 0.0005 Å
• b: 10.7596 ± 0.0006 Å
• c: 14.1625 ± 0.0008 Å
• α: 77.029 ± 0.002°
• β: 81.295 ± 0.002°
• γ: 70.083 ± 0.002°
• Cell volume: 1328.46 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0278
• Residual factor for significantly intense reflections: 0.0236
• Weighted residual factors for significantly intense reflections: 0.0583
• Weighted residual factors for all reflections included in the refinement: 0.06
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No