Information card for entry 4321564

Structure parameters

• Chemical name: Bis(trans-dichloro-bis(4-tert-butylpyridine))-di-tungsten (II), D2 isomer, acetone solvate
• Formula: C39 H58 Cl4 N4 O W2
• Calculated formula: C39 H58 Cl4 N4 O W2
• Title of publication: Alkylpyridine Complexes of Tungsten(II) and Chromium(II). First Rotational Isomers of W2X4L4 Molecules with D2 hand D2 Symmetries
• Authors of publication: F. Albert Cotton; Evgeny V. Dikarev; Jiande Gu; Santiago Herrero; Barbara Modec
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 5407 - 5411
• a: 32.97 ± 0.005 Å
• b: 10.227 ± 0.001 Å
• c: 28.962 ± 0.002 Å
• α: 90°
• β: 103.21 ± 0.01°
• γ: 90°
• Cell volume: 9507.1 ± 1.9 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0532
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for all reflections: 0.1235
• Weighted residual factors for significantly intense reflections: 0.1143
• Goodness-of-fit parameter for all reflections: 1.134
• Goodness-of-fit parameter for significantly intense reflections: 1.125
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No