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Superstructure of a Substituted Zeolitic Imidazolate Metal-Organic Framework Determined by Combining Proton Solid-State NMR Spectroscopy and DFT Calculations
- Source :
- Angewandte Chemie International Edition, Angewandte Chemie International Edition, Wiley-VCH Verlag, 2015, 54 (20), pp.5971--5976. ⟨10.1002/anie.201500518⟩, Angewandte Chemie International Edition, 2015, 54 (20), pp.5971--5976. ⟨10.1002/anie.201500518⟩
- Publication Year :
- 2015
- Publisher :
- Wiley, 2015.
-
Abstract
- SSCI-VIDE+CARE:CDFA+MBE:PVE; International audience; We report the supercell crystal structure of a ZIF-8 analog substituted imidazolate metal–organic framework (SIM-1) obtained by combining solid-state nuclear magnetic resonance and powder X-ray diffraction experiments with density functional theory calculations
- Subjects :
- 02 engineering and technology
Nuclear magnetic resonance crystallography
010402 general chemistry
01 natural sciences
Catalysis
Condensed Matter::Materials Science
chemistry.chemical_compound
metal–organic frameworks
Computational chemistry
Imidazolate
[CHIM]Chemical Sciences
Spectroscopy
metal-organic frameworks
solid-state NMR spectroscopy
Chemistry
General Chemistry
General Medicine
021001 nanoscience & nanotechnology
[SDE.ES]Environmental Sciences/Environmental and Society
0104 chemical sciences
X-ray diffraction
Density functional calculations
Solid-state nuclear magnetic resonance
X-ray crystallography
Physical chemistry
Metal-organic framework
Density functional theory
0210 nano-technology
Superstructure (condensed matter)
porous materials
Subjects
Details
- ISSN :
- 00448249, 14337851, and 15213773
- Volume :
- 127
- Database :
- OpenAIRE
- Journal :
- Angewandte Chemie
- Accession number :
- edsair.doi.dedup.....0ead651bf628a03ccc78762fd4d78428
- Full Text :
- https://doi.org/10.1002/ange.201500518