Information card for entry 7033018

Structure parameters

• Formula: C31 H47 N4 P
• Calculated formula: C31 H47 N4 P
• SMILES: P(=NN=Nc1c(cccc1C)C)(C1=C(Nc2c(cccc2C(C)C)C(C)C)CCC1)(C(C)C)C(C)C
• Title of publication: Cleavage of an aryl carbon-nitrogen bond of a phosphazido iron(II) complex promoted by hydride metathesis.
• Authors of publication: Ogawa, Takahiko; Suzuki, Tatsuya; Hein, Nicholas M.; Pick, Fraser S.; Fryzuk, Michael D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 1
• Pages of publication: 54 - 57
• a: 8.4137 ± 0.001 Å
• b: 12.3149 ± 0.0014 Å
• c: 16.0458 ± 0.0019 Å
• α: 68.433 ± 0.002°
• β: 80.379 ± 0.002°
• γ: 83.219 ± 0.003°
• Cell volume: 1521.5 ± 0.3 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0438
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.1026
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No