Information card for entry 4343559

Structure parameters

• Formula: C35 H56 N2 P2
• Calculated formula: C35 H56 N2 P2
• SMILES: P(=Nc1ccccc1P(C(C)C)C(C)C)(C1=C(Nc2c(cccc2C(C)C)C(C)C)CCC1)(C(C)C)C(C)C
• Title of publication: N2 Activation by an Iron Complex with a Strong Electron-Donating Iminophosphorane Ligand.
• Authors of publication: Suzuki, Tatsuya; Wasada-Tsutsui, Yuko; Ogawa, Takahiko; Inomata, Tomohiko; Ozawa, Tomohiro; Sakai, Yoichi; Fryzuk, Michael D.; Masuda, Hideki
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 19
• Pages of publication: 9271 - 9281
• a: 11.4502 ± 0.0012 Å
• b: 17.5263 ± 0.0017 Å
• c: 19.427 ± 0.002 Å
• α: 64.925 ± 0.003°
• β: 82.924 ± 0.005°
• γ: 75.43 ± 0.004°
• Cell volume: 3417 ± 0.6 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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 significantly intense reflections: 0.0522
• Weighted residual factors for all reflections included in the refinement: 0.1528
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No