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. 2015 Sep 12;71(Pt 10):1140–1142. doi: 10.1107/S205698901501628X

Table 2. Experimental details.

Crystal data
Chemical formula C27H21FN2O4
M r 456.46
Crystal system, space group Triclinic, P Inline graphic
Temperature (K) 293
a, b, c () 9.7270(19), 10.122(2), 13.441(3)
, , () 68.15(3), 73.69(3), 89.73(3)
V (3) 1171.4(4)
Z 2
Radiation type Mo K
(mm1) 0.09
Crystal size (mm) 0.30 0.20 0.10
 
Data collection
Diffractometer Nonius CAD-4 diffractometer
Absorption correction scan (North et al., 1968)
T min, T max 0.973, 0.991
No. of measured, independent and observed [I > 2(I)] reflections 4587, 4311, 2756
R int 0.040
(sin /)max (1) 0.603
 
Refinement
R[F 2 > 2(F 2)], wR(F 2), S 0.054, 0.147, 1.00
No. of reflections 4311
No. of parameters 307
H-atom treatment H-atom parameters constrained
max, min (e 3) 0.16, 0.18

Computer programs: CAD-4 EXPRESS (EnrafNonius, 1994), XCAD4 (Harms Wocadlo, 1995), SHELXTL (Sheldrick, 2008).