Information card for entry 1556454

Structure parameters

• Formula: C72 H83 Gd I2 N2 O2 P2
• Calculated formula: C72 H83 Gd I2 N2 O2 P2
• SMILES: C12P(c3ccccc3)(c3ccccc3)=[N](c3c(cc(cc3C)C)C)[Gd]2(I)(I)([N](=P1(c1ccccc1)c1ccccc1)c1c(C)cc(C)cc1C)([O]1CCCC1)[O]1CCCC1.c1cc(C)ccc1.Cc1ccccc1.Cc1ccccc1
• Title of publication: Synthesis and Characterisation of Lanthanide N-Trimethylsilyl and -Mesityl Functionalised Bis(iminophosphorano)methanides and -Methanediides
• Authors of publication: Marshall, G.; Wooles, A.J.; Mills, D.P.; Lewis, W.; Blake, A.J.; Liddle, S.T.
• Journal of publication: Inorganics
• Year of publication: 2013
• Journal volume: 1
• Pages of publication: 46 - 69
• a: 12.7851 ± 0.0006 Å
• b: 15.122 ± 0.0008 Å
• c: 17.2635 ± 0.0009 Å
• α: 85.091 ± 0.002°
• β: 76.608 ± 0.002°
• γ: 87.266 ± 0.002°
• Cell volume: 3233.7 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 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: 0.0475
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.109
• Weighted residual factors for all reflections included in the refinement: 0.114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No