Information card for entry 4320294

Structure parameters

• Formula: C22 H24 I N2 P Si
• Calculated formula: C22 H24 I N2 P Si
• SMILES: C(#N)I.c1(ccccc1)P(c1ccccc1)(c1ccccc1)=N[Si](C)(C)C
• Title of publication: [Me3SiN(PPh3).ICN]: A New Labile Donor-Acceptor Complex
• Authors of publication: Rhett Kempe; Elmar Kessenich; Axel Schulz
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 5182 - 5187
• a: 26.991 ± 0.005 Å
• b: 8.338 ± 0.002 Å
• c: 42.892 ± 0.009 Å
• α: 90°
• β: 92.05 ± 0.03°
• γ: 90°
• Cell volume: 9647 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0528
• Residual factor for significantly intense reflections: 0.0396
• Weighted residual factors for all reflections: 0.1047
• Weighted residual factors for significantly intense reflections: 0.0982
• Goodness-of-fit parameter for all reflections: 0.964
• Goodness-of-fit parameter for significantly intense reflections: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No