C~12~H~18~N~2~O~2~, H~2~O

Sample Originator: Patrick J. Murphya.

Data Collection: Peter N. Hortonb and Michael B. Hursthouseb

Structure Determination: Peter N. Hortonb.

University of North Walesa
University of Southamptonb



Controlled Keywords:organic compounds, polymers
Date Created:08 October 2003
Deposited On:28 Mar 2012 13:04
Deposited By:Mr Steve Lamond

Depositor Comments

All hydrogen atoms were fixed.

Data collection parameters

Chemical formulaC12 H20 N2 O3
Crystal morphology
Crystal systemOrthorhombic
Space group symbolP2(1)2(1)2(1)
Cell length a4.7254(3)
Cell length b9.6175(7)
Cell length c27.407(2)
Cell angle alpha90.00
Cell angle beta90.00
Cell angle gamma90.00
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0637
R Factor (Obs)0.0859
R Factor (All)0.1314
Weighted R Factor (Obs)0.2001
Weighted R Factor (All)0.2348

Citation: Murphy, Patrick J. and Horton, Peter N. and Hursthouse, Michael B. (2003) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1154/)
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