Information card for entry 4331917

Structure parameters

• Formula: C47 H48 Cl6 N4 Nd2 O11 Zn2
• Calculated formula: C47 H48 Cl6 N4 Nd2 O11 Zn2
• SMILES: [Nd]1234([O]5[Zn]67(Cl)[O]3c3c([O]2C)cccc3C=[N]7c2ccccc2[N]6=Cc2cccc([O]4C)c25)([Cl][Nd]234([O]5[Zn]67(Cl)[O]3c3c([O]2C)cccc3C=[N]7c2ccccc2[N]6=Cc2cccc([O]4C)c25)([Cl]1)(Cl)[OH]C)(Cl)[OH]C.OC
• Title of publication: Multinuclear Luminescent Schiff-Base Zn−Nd Sandwich Complexes
• Authors of publication: Wong, Wai-Kwok; Yang, Xiaoping; Jones, Richard A.; Rivers, Joseph H.; Lynch, Vince; Lo, Wing-Kit; Xiao, Dang; Oye, Michael M.; Holmes, Archie L.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 11
• Pages of publication: 4340 - 4345
• a: 13.516 ± 0.003 Å
• b: 14.284 ± 0.003 Å
• c: 14.358 ± 0.003 Å
• α: 82.55 ± 0.03°
• β: 76.2 ± 0.03°
• γ: 72.59 ± 0.03°
• Cell volume: 2563.6 ± 1.1 ų
• Cell temperature: 153 ± 1 K
• Ambient diffraction temperature: 153 ± 1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1049
• Residual factor for significantly intense reflections: 0.0508
• Weighted residual factors for significantly intense reflections: 0.1084
• Weighted residual factors for all reflections included in the refinement: 0.1277
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No