Information card for entry 7039316

Structure parameters

• Formula: C14 H24 Cl Ge N2 P
• Calculated formula: C14 H24 Cl Ge N2 P
• SMILES: [Ge]1(Cl)[N](=P(c2ccccc2)N1C(C)(C)C)C(C)(C)C
• Title of publication: Germylenes and stannylenes stabilized within N2PE rings (E = Ge or Sn): combined experimental and theoretical study.
• Authors of publication: Vrána, Jan; Ketkov, Sergey; Jambor, Roman; Růžička, Aleš; Lyčka, Antonín; Dostál, Libor
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 25
• Pages of publication: 10343 - 10354
• a: 14.826 ± 0.0006 Å
• b: 10.263 ± 0.0007 Å
• c: 11.3191 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1722.3 ± 0.2 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 K
• Number of distinct elements: 6
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0311
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for significantly intense reflections: 0.0541
• Weighted residual factors for all reflections included in the refinement: 0.0578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No