Information card for entry 7006909

Structure parameters

• Formula: C28 H48 Mo N10
• Calculated formula: C28 H48 Mo N10
• SMILES: [Mo](n1nc(cc1C)C)(n1nc(cc1C)C)([n]1[nH]c(cc1C)C)(=NC(C)(C)C)(=NC(C)(C)C)[n]1[nH]c(cc1C)C
• Title of publication: Film growth precursor development for metal nitrides. Synthesis, structure, and volatility of molybdenum(VI) and tungsten(VI) complexes containing bis(imido)metal fragments and various nitrogen donor ligands.
• Authors of publication: El-Kadri, Oussama M; Heeg, Mary Jane; Winter, Charles H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 16
• Pages of publication: 1943 - 1953
• a: 9.751 ± 0.0011 Å
• b: 9.8157 ± 0.001 Å
• c: 17.518 ± 0.002 Å
• α: 90°
• β: 100.306 ± 0.002°
• γ: 90°
• Cell volume: 1649.6 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0649
• Weighted residual factors for all reflections included in the refinement: 0.0705
• Goodness-of-fit parameter for all reflections included in the refinement: 0.94
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No