Information card for entry 4085495

Structure parameters

• Common name: Compound 5
• Formula: C33 H46 Cr N2
• Calculated formula: C33 H46 Cr N2
• Title of publication: Low-Valent Aminopyridinato Chromium Methyl Complexes via Reductive Alkylation and via Oxidative Addition of Iodomethane by a Cr‒Cr Quintuple Bond
• Authors of publication: Noor, Awal; Schwarz, Stefan; Kempe, Rhett
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 2122
• a: 14.618 ± 0.0011 Å
• b: 13.33 ± 0.0011 Å
• c: 16.947 ± 0.0013 Å
• α: 90°
• β: 113.198 ± 0.006°
• γ: 90°
• Cell volume: 3035.3 ± 0.4 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1471
• Residual factor for significantly intense reflections: 0.0846
• Weighted residual factors for significantly intense reflections: 0.208
• Weighted residual factors for all reflections included in the refinement: 0.2321
• Goodness-of-fit parameter for all reflections included in the refinement: 0.948
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No