Information card for entry 7103524

Structure parameters

• Formula: C29 H18 F6 O4 Ru2 S2
• Calculated formula: C29 H18 F6 O4 Ru2 S2
• SMILES: [Ru]1234(C5=CC6=C7C(=C8C(SC(=C8)[Ru]89%10%11([cH]%12[cH]%11[cH]%10[cH]9[cH]8%12)(C#[O])C#[O])(C6(S5)C)C)C(F)(F)C(F)(F)C7(F)F)([cH]5[cH]1[cH]2[cH]3[cH]45)(C#[O])C#[O]
• Title of publication: Remarkable switching behavior of bimodally stimuli-responsive photochromic dithienylethenes with redox-active organometallic attachments.
• Authors of publication: Motoyama, Keiko; Koike, Takashi; Akita, Munetaka
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2008
• Journal issue: 44
• Pages of publication: 5812 - 5814
• a: 11.026 ± 0.006 Å
• b: 11.113 ± 0.005 Å
• c: 13.278 ± 0.007 Å
• α: 97.04 ± 0.02°
• β: 98.67 ± 0.02°
• γ: 114.02 ± 0.02°
• Cell volume: 1438 ± 1 ų
• Cell temperature: 213 K
• Ambient diffraction temperature: 213 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0567
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1652
• Weighted residual factors for all reflections included in the refinement: 0.1678
• Goodness-of-fit parameter for all reflections included in the refinement: 1.491
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No