Information card for entry 7233196

Structure parameters

• Formula: C29 H36 N2 O2
• Calculated formula: C29 H36 N2 O2
• SMILES: O(c1ccc(c2ccc(/N=N/c3cc(c(OCCCCCC)c(c3)C)C)cc2C)cc1)CC
• Title of publication: A design strategy for stable light-sensitive palladium complexes
• Authors of publication: Tomohiro Hirade; Yumi Okui; Mina Han
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2013
• Journal volume: 1
• Pages of publication: 2672 - 2679
• a: 8.0239 ± 0.0013 Å
• b: 8.2206 ± 0.001 Å
• c: 19.4355 ± 0.0017 Å
• α: 78.047 ± 0.016°
• β: 85.5 ± 0.02°
• γ: 86.15 ± 0.02°
• Cell volume: 1248.6 ± 0.3 ų
• Cell temperature: 113 K
• Ambient diffraction temperature: 113 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.068
• Weighted residual factors for all reflections included in the refinement: 0.1833
• Goodness-of-fit parameter for all reflections included in the refinement: 0.86
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No