The structures were solved by direct methods using SIR97 [35] (link) and refined by fullmatrix least-squares methods using the program SHELXL97 [36] using the winGX software package [37] (link). Non-hydrogen atoms were refined with anisotropic thermal parameters, except in cases of disorder where these specific atoms were refined as isotropic, whereas H-atoms were placed in idealized positions and allowed to refine riding on the parent C atom. Molecular graphics were prepared using ORTEP [38] (link).
Sadabs
SADABS is a software program developed by Bruker for the empirical determination of absorption corrections in single-crystal X-ray diffraction experiments. It provides a robust and reliable method to account for the effects of sample absorption, improving the accuracy of the collected data.
Lab products found in correlation
912 protocols using sadabs
Single Crystal X-Ray Diffraction Analysis
The structures were solved by direct methods using SIR97 [35] (link) and refined by fullmatrix least-squares methods using the program SHELXL97 [36] using the winGX software package [37] (link). Non-hydrogen atoms were refined with anisotropic thermal parameters, except in cases of disorder where these specific atoms were refined as isotropic, whereas H-atoms were placed in idealized positions and allowed to refine riding on the parent C atom. Molecular graphics were prepared using ORTEP [38] (link).
Bruker X8 APEX Diffractometer Protocol
Bruker X8 APEX diffractometer
Absorption correction: multi-scan (SADABS; Bruker, 2009 ▸ ) Tmin = 0.589, Tmax = 0.746
9214 measured reflections
3582 independent reflections
2406 reflections with I > 2σ(I)
Rint = 0.040
Single Crystal X-Ray Diffraction Analysis
Bruker SMART CCD 1K area-detector diffractometer
Absorption correction: multi-scan (SADABS; Bruker, 2012 ▸ ) Tmin = 0.701, Tmax = 0.746
27028 measured reflections
3964 independent reflections
3582 reflections with I > 2σ(I)
Rint = 0.021
Single Crystal X-ray Diffraction
Bruker Kappa APEXII CCD diffractometer
Absorption correction: multi-scan (SADABS; Bruker, 2004 ▸ ) Tmin = 0.948, Tmax = 0.955
14793 measured reflections
1809 independent reflections
1528 reflections with I > 2σ(I)
Rint = 0.023
Single Crystal X-ray Diffraction Analysis
Bruker APEXII CCD diffractometer
Absorption correction: multi-scan (SADABS; Bruker, 2008 ▸ ) Tmin = 0.92, Tmax = 0.95
46817 measured reflections
5318 independent reflections
4636 reflections with I > 2σ(I)
Rint = 0.035
Crystal Structure Determination by X-ray Diffraction
Bruker APEXII CCD diffractometer
Absorption correction: multi-scan (SADABS; Bruker, 2005 ▸ ) Tmin = 0.715, Tmax = 0.890
8297 measured reflections
3028 independent reflections
2686 reflections with I > 2σ(I)
Rint = 0.030
Crystal Structure Determination Protocol
Bruker Kappa APEXII CCD diffractometer
Absorption correction: multi-scan (SADABS; Bruker, 2004 ▸ ) Tmin = 0.981, Tmax = 0.985
10595 measured reflections
3454 independent reflections
1668 reflections with I > 2σ(I)
Rint = 0.039
Single Crystal X-ray Diffraction
Bruker Kappa APEXII CCD diffractometer
Absorption correction: multi-scan (SADABS; Bruker, 2008 ▸ ) Tmin = 0.941, Tmax = 0.960
7690 measured reflections
3638 independent reflections
2447 reflections with I > 2σ(I)
Rint = 0.038
Single Crystal X-Ray Diffraction Protocol
Bruker X8 APEX diffractometer
Absorption correction: multi-scan (SADABS; Bruker, 2009 ▸ ) Tmin = 0.670, Tmax = 0.746
25334 measured reflections
4082 independent reflections
3071 reflections with I > 2σ(I)
Rint = 0.031
CMOS Diffractometer for Crystal Characterization
Bruker D8 VENTURE PHOTON 100 CMOS diffractometer
Absorption correction: multi-scan (SADABS; Bruker, 2014 ▸ ) Tmin = 0.90, Tmax = 0.95
11331 measured reflections
3063 independent reflections
2538 reflections with I > 2σ(I)
Rint = 0.031
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