Enantiopure Ibuprofen - Sample 3 NanED, Data ESR1 & ESR2

General Information   Project NanED (www.naned.eu) ESR Project ESR1 & ESR2 Instrumental   Instrument Zeiss Libra 120 Radiation source LaB6 Accelerating voltage 120 kV Wavelength 0.0335 Å Probe Type Nanodiffraction Beam Diameter 600 nm Beam Convergence Parallel beam Detector Timepix Single Electron Detector Number of pixels in the image 512 x 512 Physical pixel size 55 µm * 55 µm Effective camera length 180 mm Calibration constant 0.004815 Å-1/pixel     Sample description   Name Ibuprofen Chemical composition C13H18O2 Sample source Thermo Scientific (catalog. No: 333200050, lot: A0424385) Sample preparation Crushed between two glass slides     Experimental   Data type 3D Electron Diffraction (3D-ED) Data collection method Continuous Rotation Electron Diffraction (CRED) Rotation Speed 1.125 º/s Temperature 95.15 K Number of crystals contributing to the dataset 1 Number of experimental frames 226 Tilt range, tilt step -60º to +55, 0.5º Exposure time per frame 450 ms     Software   Software used for data collection WinTEM (Zeiss), Digistar (NanoMEGAS) and Sophy (Software for Physics) Software used for processing Pets2 Software used for solution Shelxt Software used for refinement Jana, Olex2     Authorship and bibliography   Author(s) of the data Moussa Diame FAYE (ESR1) & Vincentia Emerson Agbemeh (ESR2) Related data   Publication(s)         Precession: General Information   Project NanED (www.naned.eu) ESR Project ESR1 & ESR2 Instrumental   Instrument Zeiss Libra 120 Radiation source LaB6 Accelerating voltage 120 kV Wavelength 0.0335 Å Probe Type Nanodiffraction Beam Diameter 150 nm Beam Convergence Parallel beam Detector Timepix Single Electron Detector Number of pixels in the image 512 x 512 Physical pixel size 55 µm * 55 µm Effective camera length 180 mm Calibration constant 0.004815 Å-1/pixel     Sample description   Name Ibuprofen Chemical composition C13H18O2 Sample source Thermo Scientific (catalog. No: 333200050, lot: A0424385) Sample preparation Crushed between two glass slides     Experimental   Data type 3D Electron Diffraction (3D-ED) Data collection method Precession Precession Semiangle 1º   Temperature 95.15 K Number of crystals contributing to the dataset 1 Number of experimental frames 104 Tilt range, tilt step -60 to +55, 1º Exposure time per frame 1000 ms     Software   Software used for data collection WinTEM (Zeiss), Digistar (NanoMEGAS) and Sophy (Software for Physics) Software used for processing PETS2 Software used for solution Shelxt Software used for refinement Jana     Authorship and bibliography   Author(s) of the data Moussa Diame FAYE (ESR1) & Vincentia Emerson Agbemeh (ESR2) Related data   Publication(s)