Information card for entry 7243640

Structure parameters

• Formula: C29 H31 Cl3 Cu2 Fe2 I2 N2 S4
• Calculated formula: C29 H31 Cl3 Cu2 Fe2 I2 N2 S4
• Title of publication: Ferrocenyl thiazolidine-2-thione ornamented 1D coordination polymers derived from coinage metal halides and pseudohalides
• Authors of publication: Singh, Ayushi; Trivedi, Manoj; Kociok-Köhn, Gabriele; Singh, Ashish Kumar; Muddassir, Mohd.; Kumar, Abhinav
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 44
• Pages of publication: 7794 - 7804
• a: 5.9876 ± 0.0003 Å
• b: 17.204 ± 0.0008 Å
• c: 17.2608 ± 0.0008 Å
• α: 89.062 ± 0.008°
• β: 84.677 ± 0.008°
• γ: 87.989 ± 0.007°
• Cell volume: 1769.13 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 149.99 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0636
• Residual factor for significantly intense reflections: 0.0486
• Weighted residual factors for significantly intense reflections: 0.0966
• Weighted residual factors for all reflections included in the refinement: 0.1018
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No