Information card for entry 4126071

Structure parameters

• Common name: SVK2_207
• Chemical name: SVK2_207
• Formula: C25 H29 F18 Mo N O5
• Calculated formula: C25 H29 F18 Mo N O5
• SMILES: [Mo]1(OC(C(F)(F)F)(C)C(F)(F)F)(OC(C(F)(F)F)(C)C(F)(F)F)([O](CC[O]1C)C)(OC(C)(C(F)(F)F)C(F)(F)F)#Cc1ccc(N(C)C)cc1
• Title of publication: Regioselective Carbyne Transfer to Ring-Opening Alkyne Metathesis Initiators Gives Access to Telechelic Polymers.
• Authors of publication: von Kugelgen, Stephen; Sifri, Renee; Bellone, Donatela; Fischer, Felix R.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• a: 14.3977 ± 0.0005 Å
• b: 14.4686 ± 0.0006 Å
• c: 15.8068 ± 0.0007 Å
• α: 90°
• β: 100.49 ± 0.002°
• γ: 90°
• Cell volume: 3237.8 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0426
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for significantly intense reflections: 0.0997
• Weighted residual factors for all reflections included in the refinement: 0.1021
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No