Skip to main content
. 2015 Jan 28;71(Pt 2):223–225. doi: 10.1107/S2056989015001486

Table 2. Experimental details.

Crystal data
Chemical formula C26H40N3O2 +ClO4
M r 526.06
Crystal system, space group Monoclinic, P21/n
Temperature (K) 293
a, b, c () 10.0605(3), 12.7027(4), 23.1455(6)
() 94.107(3)
V (3) 2950.29(14)
Z 4
Radiation type Mo K
(mm1) 0.17
Crystal size (mm) 0.57 0.32 0.09
 
Data collection
Diffractometer Agilent Xcalibur Sapphire3
Absorption correction Multi-scan (CrysAlis PRO; Agilent, 2014)
T min, T max 0.951, 1.000
No. of measured, independent and observed [I > 2(I)] reflections 27330, 6037, 4458
R int 0.029
(sin /)max (1) 0.626
 
Refinement
R[F 2 > 2(F 2)], wR(F 2), S 0.060, 0.179, 1.04
No. of reflections 6037
No. of parameters 363
No. of restraints 87
H-atom treatment H-atom parameters constrained
max, min (e 3) 0.37, 0.33

Computer programs: CrysAlis PRO (Agilent, 2014), SHELXD (Sheldrick, 2008), SHELXL97 (Sheldrick, 2015) and OLEX2 (Dolomanov et al., 2009).