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octakis(Isobutyl)octasilsesquioxane

Sample Originator: I. A. MacKinnon, Z. Liu, P. G. Taylor, Y. Yang, Michael B. Hursthouse, Peter N. Horton, Mark E. Light and A. R. Bassindale.

C16H36O6Si4

InChI=1/C16H36O6Si4/c1-13(2)9-23-19-24(10-14(3)4)21-26(18,12-16(7)8)22-25(17,20-23)11-15(5)6/h13-16H,9-12H2,1-8H3/t25-,26+

Identification Number:10.5258/ecrystals/59
Date Created:20 December 2001
Deposited On:21 Jan 2008 15:28
Deposited By:A.N. Admin

Depositor Comments

http://www.rsc.org/delivery/_ArticleLinking/ArticleLinking.cfm?JournalCode=DT&Year=2003&ManuscriptID=b302950f&Iss=14

Data collection parameters

Chemical formulaC16 H36 O6 Si4
Crystal morphology
Crystal systemTriclinic
Space group symbolP-1
Cell length a9.9881(13)
Cell length b10.8183(14)
Cell length c10.9540(18)
Cell angle alpha96.541(8)
Cell angle beta91.269(7)
Cell angle gamma99.439(7)
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0841
R Factor (All)0.2189
Weighted R Factor (Obs)0.1572
Weighted R Factor (All)0.2024

Citation: MacKinnon, I. A. and Liu, Z. and Taylor, P. G. and Yang, Y. and Hursthouse, Michael B. and Horton, Peter N. and Light, Mark E. and Bassindale, A. R. (2001) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/59)
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Available Files

Final Result

01SRC993.CIF14k
01src993.cml9k

Validation

01SRC993_checkcif.htm9k

Refinement

01src993.RES8k
01src993_xl.lst43k

Solution

01src993.PRP4k

Processing

01SRC993.htm6k
01src993.HKL361k

Other Files

01SRC993.doc258k
01SRC993_ellipsoid.gif25k
01src993.mol5k

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