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. 2015 Sep 26;71(Pt 10):1242–1244. doi: 10.1107/S2056989015017673

Table 2. Experimental details.

Crystal data
Chemical formula C17H21NO4
M r 303.35
Crystal system, space group Monoclinic, P21/c
Temperature (K) 173
a, b, c () 7.8662(2), 11.4601(3), 18.1517(6)
() 96.858(1)
V (3) 1624.62(8)
Z 4
Radiation type Mo K
(mm1) 0.09
Crystal size (mm) 0.26 0.19 0.09
 
Data collection
Diffractometer Nonius KappaCCD
No. of measured, independent and observed [I > 2(I)] reflections 6627, 3705, 2183
R int 0.054
(sin /)max (1) 0.649
 
Refinement
R[F 2 > 2(F 2)], wR(F 2), S 0.055, 0.127, 1.00
No. of reflections 3705
No. of parameters 203
H-atom treatment H-atom parameters constrained
max, min (e 3) 0.18, 0.19

Computer programs: KappaCCD Server Software (Nonius, 1997), HKL DENZO and SCALEPACK (Otwinovski Minor, 1997), SIR2011 (Burla et al., 2012), ORTEP-3 for Windows (Farrugia, 2012), SHELXL97 (Sheldrick, 2008), PLATON (Spek, 2009) and publCIF (Westrip, 2010).