Information card for entry 4300977

Structure parameters

• Common name: EISTH09
• Formula: C54 H36 N4 Pt
• Calculated formula: C54 H36 N4 Pt
• SMILES: C(#Cc1ccc(cc1)/C=N/c1ccccc1)[Pt]1([n]2ccc(c3c2c2[n]1ccc(c2cc3)c1ccccc1)c1ccccc1)C#Cc1ccc(cc1)/C=N/c1ccccc1
• Title of publication: Facile Synthesis, Structure, and Luminescence Properties of Pt(diimine)bis(arylacetylide) Chromophore‒Donor Dyads
• Authors of publication: Wadas, Thaddeus J.; Chakraborty, Soma; Lachicotte, Rene J.; Wang, Quan-Ming; Eisenberg, Richard
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Journal issue: 8
• Pages of publication: 2628 - 2638
• a: 22.954 ± 0.006 Å
• b: 19.501 ± 0.005 Å
• c: 11.044 ± 0.003 Å
• α: 90°
• β: 118.036 ± 0.003°
• γ: 90°
• Cell volume: 4363 ± 2 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1256
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1187
• Weighted residual factors for all reflections included in the refinement: 0.1366
• Goodness-of-fit parameter for all reflections included in the refinement: 0.944
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No