Information card for entry 7008658

Structure parameters

• Formula: C6 H15 Cl3 N3 P3
• Calculated formula: C6 H15 Cl3 N3 P3
• SMILES: P1(Cl)N(CC)P(Cl)N(CC)P(Cl)N1CC
• Title of publication: Triphosph(III)azanes to diphosph(III)azanes; a cracking transformation.
• Authors of publication: García, Felipe; Kowenicki, Richard A.; Riera, Lucía; Wright, Dominic S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 15
• Pages of publication: 2495 - 2496
• a: 5.6366 ± 0.0011 Å
• b: 10.146 ± 0.002 Å
• c: 12.707 ± 0.003 Å
• α: 87.48 ± 0.03°
• β: 82.31 ± 0.03°
• γ: 79.72 ± 0.03°
• Cell volume: 708.5 ± 0.3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0613
• Residual factor for significantly intense reflections: 0.0475
• Weighted residual factors for significantly intense reflections: 0.1157
• Weighted residual factors for all reflections included in the refinement: 0.1255
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No