Information card for entry 1548748

Structure parameters

• Common name: nitrito-pentaammine-Co(III)-chloride-nitrate
• Formula: Cl Co H15 N7 O5
• Calculated formula: Cl Co H15 N7 O5
• Title of publication: Quantification of photoinduced bending of dynamic molecular crystals: from macroscopic strain to kinetic constants and activation energies.
• Authors of publication: Chizhik, Stanislav; Sidelnikov, Anatoly; Zakharov, Boris; Naumov, Panče; Boldyreva, Elena
• Journal of publication: Chemical science
• Year of publication: 2018
• Journal volume: 9
• Journal issue: 8
• Pages of publication: 2319 - 2335
• a: 14.4836 ± 0.0012 Å
• b: 7.5409 ± 0.0004 Å
• c: 9.4574 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1032.93 ± 0.12 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0725
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1457
• Weighted residual factors for all reflections included in the refinement: 0.1751
• Goodness-of-fit parameter for all reflections included in the refinement: 1.144
• Diffraction radiation wavelength: 0.4109 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No