Information card for entry 7701574

Structure parameters

• Common name: PdD(CMP)PP
• Chemical name: [10-(Diethoxyphosphoryl)-5,15-bis{p-(methoxycarbonyl)phenyl}porphyrinato(2-)] palladium(II) chloroform solvate
• Formula: C41 H34 Cl3 N4 O7 P Pd
• Calculated formula: C41 H34 Cl3 N4 O7 P Pd
• Title of publication: Platinum(ii) and palladium(ii) complexes with electron-deficient meso-diethoxyphosphorylporphyrins: synthesis, structure and tuning of photophysical properties by varying peripheral substituents.
• Authors of publication: Volostnykh, Marina V.; Borisov, Sergey M.; Konovalov, Mikhail A.; Sinelshchikova, Anna A.; Gorbunova, Yulia G.; Tsivadze, Aslan Yu; Meyer, Michel; Stern, Christine; Bessmertnykh-Lemeune, Alla
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 24
• Pages of publication: 8882 - 8898
• a: 10.7842 ± 0.0003 Å
• b: 11.5565 ± 0.0004 Å
• c: 17.0314 ± 0.0006 Å
• α: 72.119 ± 0.002°
• β: 75.384 ± 0.002°
• γ: 85.933 ± 0.002°
• Cell volume: 1954.63 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 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: 0.0615
• Residual factor for significantly intense reflections: 0.0388
• Weighted residual factors for significantly intense reflections: 0.0766
• Weighted residual factors for all reflections included in the refinement: 0.0844
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No