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2009src1245 - C36H81DyN3O12P3

Sample Originator: Andrew Platta.

Data Collection: Peter N. Hortonb

Structure Determination: Peter N. Hortonb and Michael B. Hursthouseb.

Staffordshire Universitya
University of Southamptonb

C36H81DyN3O12P3

InChI=1/3C12H28OP.Dy.3HNO3/c3*1-10(2)7-14(13,8-11(3)4)9-12(5)6;;3*2-1(3)4/h3*10-12,14H,7-9H2,1-6H3;;3*(H-,2,3,4)/q3*-1;+6;3*-1

Identification Number:10.5258/ecrystals/1242
Controlled Keywords:lanthanide coordination, organophosphorus ligands
Date Created:23 November 2009
Deposited On:25 Jan 2010 12:23
Deposited By:Dr Peter N Horton

Depositor Comments

User Refcode:- Dy iBu

Data collection parameters

Chemical formulaC36 H81 Dy N3 O12 P3
Crystal morphologyPlate
Crystal systemtetragonal
Space group symbolP4(3)2(1)2
Cell length a15.3937(10)
Cell length b15.3937(10)
Cell length c43.421(4)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit47.08
R Factor (Obs)0.0801
R Factor (All)0.1082
Weighted R Factor (Obs)0.2233
Weighted R Factor (All)0.2577

Citation: Platt, Andrew and Horton, Peter N. and Hursthouse, Michael B. (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1242)
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