Information card for entry 7013484

Structure parameters

• Formula: C14 H18 Cl2 Cr N2
• Calculated formula: C14 H18 Cl2 Cr N2
• SMILES: [n]1(c(cccc1C)C)[Cr](Cl)([n]1c(cccc1C)C)Cl
• Title of publication: Low valent chromium complexes bearing N,O-chelating pyridyl-enolate ligands [OC(But)(?2-CHN5H3Me-x)]?�(x?=?3?6)
• Authors of publication: Gibson, Vernon C.; Newton, Claire; Redshaw, Carl; Solan, Gregory A.; White, Andrew J. P.; Williams, David J.
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 24
• Pages of publication: 4612
• a: 7.712 ± 0.002 Å
• b: 7.8885 ± 0.0007 Å
• c: 8.0404 ± 0.0013 Å
• α: 116.841 ± 0.009°
• β: 112.573 ± 0.013°
• γ: 93.814 ± 0.011°
• Cell volume: 385.56 ± 0.14 ų
• Cell temperature: 203 ± 2 K
• Ambient diffraction temperature: 203 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0337
• Residual factor for significantly intense reflections: 0.0274
• Weighted residual factors for all reflections: 0.0743
• Weighted residual factors for significantly intense reflections: 0.0699
• Goodness-of-fit parameter for all reflections: 1.104
• Goodness-of-fit parameter for significantly intense reflections: 1.127
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No