Information card for entry 4334320

Structure parameters

• Formula: C96 H120 Cl2 Cr2 N2 O6 Si2
• Calculated formula: C96 H120 Cl2 Cr2 N2 O6 Si2
• SMILES: c1(c(cc(cc1C(c1ccccc1)c1ccccc1)C)C(c1ccccc1)c1ccccc1)N([Cr]1([O]2CCCC2)[Cl][Cr](N(c2c(cc(cc2C(c2ccccc2)c2ccccc2)C)C(c2ccccc2)c2ccccc2)[Si](C)(C)C)([O]2CCCC2)[Cl]1)[Si](C)(C)C.O1CCCC1.O1CCCC1.O1CCCC1.O1CCCC1
• Title of publication: Extremely Bulky Amido First Row Transition Metal(II) Halide Complexes: Potential Precursors to Low Coordinate Metal-Metal Bonded Systems
• Authors of publication: Jamie Hicks; Cameron Jones
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 3900 - 3907
• a: 11.8071 ± 0.0005 Å
• b: 13.1447 ± 0.0006 Å
• c: 15.4536 ± 0.0008 Å
• α: 70.737 ± 0.004°
• β: 71.481 ± 0.004°
• γ: 81.584 ± 0.004°
• Cell volume: 2144.58 ± 0.19 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 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: 0.076
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.1103
• Weighted residual factors for all reflections included in the refinement: 0.1262
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No