Information card for entry 7233132

Structure parameters

• Formula: C27 H26 Gd N6 O14
• Calculated formula: C27 H27 Gd N6 O14
• SMILES: [Gd]123456([n]7c(C(=O)O3)cccc7C(=O)O2)([n]2c(cccc2C(=O)O5)C(=O)O1)[n]1c(C(=O)O6)cccc1C(=O)O4.C[NH2+]C.O.[NH2+](C)C.C[NH2+]C.O
• Title of publication: Full-colour fluorescent materials based on mixed-lanthanide(III) metal-organic complexes with high-efficiency white light emission
• Authors of publication: Huabin Zhang; Xiaochen Shan; Liujiang Zhou; Ping Lin; Renfu Li; En Ma; Xiangguang Guo; Shaowu Du
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2013
• Journal volume: 1
• Pages of publication: 888 - 891
• a: 10.701 ± 0.002 Å
• b: 16.98 ± 0.004 Å
• c: 18.627 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3384.6 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P c 21 n
• Hall space group symbol: P -2n -2ac
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for significantly intense reflections: 0.0821
• Weighted residual factors for all reflections included in the refinement: 0.1066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No