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2,2-(3'-amino-1'-propanoxy)-4,6-oxy(tetraethyleneoxy)-4,6-dichlorocyclotriphosphazatriene

Sample Originator: Michael B. Hursthouse and Simon J. Coles.

C11H23Cl2N4O6P3

InChI=1/4C11H23Cl2N4O6P3/c4*12-24-15-25(13,17-26(16-24)14-2-1-3-23-26)22-11-9-20-7-5-18-4-6-19-8-10-21-24/h4*14H,1-11H2

Identification Number:10.5258/ecrystals/147
Controlled Keywords:cyclotriphosphazene
Date Created:18 October 2004
Deposited On:21 Jan 2008 15:29
Deposited By:A.N. Admin

Data collection parameters

Chemical formulaC11 H23 Cl2 N4 O6 P3
Crystal morphologyBlade
Crystal systemOrthorhombic
Space group symbolP2(1)2(1)2(1)
Cell length a13.648(3)
Cell length b17.348(3)
Cell length c33.734(8)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0840
R Factor (Obs)0.0613
R Factor (All)0.1038
Weighted R Factor (Obs)0.1190
Weighted R Factor (All)0.1362

Citation: Hursthouse, Michael B. and Coles, Simon J. (2004) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/147)
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