Information card for entry 7030817

Structure parameters

• Formula: C16 H14 Cl2 N2 O2 Pt
• Calculated formula: C16 H14 Cl2 N2 O2 Pt
• SMILES: [Pt]12([N](C)=Cc3c(O1)cc(Cl)cc3)Oc1c(C=[N]2C)ccc(Cl)c1
• Title of publication: Solid-state emission enhancement in vaulted trans-bis(salicylaldiminato)platinum(ii) crystals with halogen functionality.
• Authors of publication: Komiya, Naruyoshi; Okada, Minoru; Fukumoto, Kanako; Iwata, Shotaro; Naota, Takeshi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 26
• Pages of publication: 10074 - 10085
• a: 19.0605 ± 0.0012 Å
• b: 10.8765 ± 0.0007 Å
• c: 7.6109 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1577.83 ± 0.18 ų
• Cell temperature: 113.1 K
• Ambient diffraction temperature: 113 K
• Number of distinct elements: 6
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for significantly intense reflections: 0.0179
• Weighted residual factors for all reflections included in the refinement: 0.0309
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No