Information card for entry 7103525

Structure parameters

• Formula: C63 H48 F6 Fe2 O2 P2 S2
• Calculated formula: C63 H48 F6 Fe2 O2 P2 S2
• 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: 8.607 ± 0.006 Å
• b: 16.521 ± 0.009 Å
• c: 20.23 ± 0.01 Å
• α: 90°
• β: 100.12 ± 0.02°
• γ: 90°
• Cell volume: 2832 ± 2 ų
• Cell temperature: 213.2 K
• Ambient diffraction temperature: 213 K
• Number of distinct elements: 7
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1225
• Residual factor for significantly intense reflections: 0.0724
• Weighted residual factors for significantly intense reflections: 0.1981
• Weighted residual factors for all reflections included in the refinement: 0.2142
• Goodness-of-fit parameter for all reflections included in the refinement: 1.208
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No