Information card for entry 2012238

Structure parameters

• Formula: C30 H64 N12 O6 P4
• Calculated formula: C30 H64 N12 O6 P4
• SMILES: C1COCCN1P1(=NP(N2CCOCC2)(NCCC)=NP(=NP(N2CCOCC2)(NCCC)=N1)(N1CCOCC1)N1CCOCC1)N1CCOCC1
• Title of publication: <i>trans</i>-2,4,4,6,8,8-Hexamorpholino-2,6-bis(<i>n</i>-propylamino)cyclo-2λ^5^,4λ^5^,6λ^5^,8λ^5^-tetraphosphazatetraene
• Authors of publication: Öztürk, Levent; Hökelek, Tuncer; Işıklan, Muhammed; Kılıç, Zeynel
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 10
• Pages of publication: 1228 - 1230
• a: 8.502 ± 0.008 Å
• b: 10.939 ± 0.014 Å
• c: 11.814 ± 0.007 Å
• α: 66.39 ± 0.09°
• β: 81.63 ± 0.07°
• γ: 81.74 ± 0.1°
• Cell volume: 991.6 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1245
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for all reflections included in the refinement: 0.1828
• Goodness-of-fit parameter for all reflections included in the refinement: 0.885
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No