Information card for entry 7235330

Structure parameters

• Formula: C34 H54 Cd I2 N2 O2
• Calculated formula: C34 H54 Cd I2 N2 O2
• Title of publication: Intramolecular cyclization‒decyclization of new sterically hindered diiminophenol. Synthesis and coordination abilities
• Authors of publication: Abakumov, Gleb A.; Druzhkov, Nikolay O.; Egorova, Elena N.; Kocherova, Tatiana N.; Shavyrin, Andrey S.; Cherkasov, Anton V.
• Journal of publication: RSC Adv.
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 28
• Pages of publication: 14495
• a: 19.3052 ± 0.0006 Å
• b: 11.9215 ± 0.0004 Å
• c: 19.4653 ± 0.0007 Å
• α: 90°
• β: 119.466 ± 0.001°
• γ: 90°
• Cell volume: 3900.4 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0276
• Residual factor for significantly intense reflections: 0.0229
• Weighted residual factors for significantly intense reflections: 0.055
• Weighted residual factors for all reflections included in the refinement: 0.0566
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No