Atomic Properties of N2O4 Based on Its Experimental Charge Density
Author:
Affiliation:
1. Institute for Chemistry/Crystallography, Free University Berlin, Takustrasse 6, 14195 Berlin, Germany, and Department of Chemistry, National University of Singapore, Kent Ridge, Singapore 119260
Publisher
American Chemical Society (ACS)
Subject
Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis
Link
https://pubs.acs.org/doi/pdf/10.1021/ja011802c
Reference19 articles.
1. Calculation of the average properties of atoms in molecules. II
2. Evaluation of net atomic charges and atomic and molecular electrostatic moments through topological analysis of the experimental charge density
3. The structure of dinitrogen tetroxide N2O4: Neutron diffraction study at 100, 60, and 20 K and ab initio theoretical calculations
4. Crystal data collected with Bruker Smart 1000: a= 7.764(1) Å, cubic, space groupIm3̄,Z= 6, 16918 reflections (712 unique,Rint= 2.83%) were collected atT= 100 K, λ = 0.71073 Å (sin(θmax/λ) = 1.249 Å-1).
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