Information card for entry 7002495

Structure parameters

• Formula: C58 H50 N2 O2 P2 Pt S2
• Calculated formula: C58 H50 N2 O2 P2 Pt S2
• SMILES: C1C(CS[Pt]([P](c2ccccc2)(c2ccccc2)c2ccccc2)([P](c2ccccc2)(c2ccccc2)c2ccccc2)S1)C(=O)Oc1ccc(cc1)N=Nc1ccccc1.c1ccccc1
• Title of publication: Photoresponsive SAMs on gold fabricated from azobenzene-functionalised asparagusic acid derivatives
• Authors of publication: Siemeling, Ulrich; Bruhn, Clemens; Bretthauer, Frauke; Borg, Marta; Träger, Frank; Vogel, Florian; Azzam, Waleed; Badin, Mihaela; Strunskus, Thomas; Wöll, Christof
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 40
• Pages of publication: 8593 - 8604
• a: 11.3328 ± 0.001 Å
• b: 14.7162 ± 0.0013 Å
• c: 15.1442 ± 0.0013 Å
• α: 98.983 ± 0.007°
• β: 92.568 ± 0.007°
• γ: 99.832 ± 0.007°
• Cell volume: 2451.4 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 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: 0.0738
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.0737
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 0.865
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No