Information card for entry 7250972

Structure parameters

• Formula: C19 H12 Br Cl4 I N2 Pt
• Calculated formula: C19 H12 Br Cl4 I N2 Pt
• Title of publication: Crystal engineering with ambidentate thiocyanate: thiocyanate nitrogen as a halogen bond acceptor in platinum(ii) complexes
• Authors of publication: Antonova, Elina V.; Kashina, Maria V.; Ivanov, Daniil M.; Bokach, Nadezhda A.; Kinzhalov, Mikhail A.
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 42
• Pages of publication: 6942 - 6948
• a: 9.0883 ± 0.0003 Å
• b: 9.8987 ± 0.0004 Å
• c: 13.0781 ± 0.0005 Å
• α: 73.195 ± 0.003°
• β: 81.969 ± 0.003°
• γ: 88.63 ± 0.003°
• Cell volume: 1115.08 ± 0.07 ų
• Cell temperature: 297.88 ± 0.1 K
• Ambient diffraction temperature: 297.88 ± 0.1 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: 0.0289
• Residual factor for significantly intense reflections: 0.0243
• Weighted residual factors for significantly intense reflections: 0.0505
• Weighted residual factors for all reflections included in the refinement: 0.0524
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No