Information card for entry 7124489

Structure parameters

• Formula: C4 H4 Br2 Cu N4 O2 Pt
• Calculated formula: C4 Br2 Cu N4 O2 Pt
• Title of publication: Designing anisotropic cyanometallate coordination polymers with unidirectional thermal expansion (TE): 2D zero and 1D colossal positive TE.
• Authors of publication: Sergeenko, Ania S.; Ovens, Jeffrey S.; Leznoff, Daniel B.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 13
• Pages of publication: 1599 - 1602
• a: 7.3275 ± 0.0001 Å
• b: 10.5863 ± 0.0002 Å
• c: 7.1618 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 555.549 ± 0.015 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 7
• Space group number: 65
• Hermann-Mauguin space group symbol: C m m m
• Hall space group symbol: -C 2 2
• Residual factor for all reflections: 0.0175
• Residual factor for significantly intense reflections: 0.0173
• Weighted residual factors for significantly intense reflections: 0.0423
• Weighted residual factors for all reflections included in the refinement: 0.0424
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No