Terbium and Europium Chlorocyananilate-Based 2D Coordination Polymers
Abstract
:1. Introduction
2. Results
3. Conclusions
4. Materials and Methods
4.1. Cell Determination from X-ray Diffraction Data
4.2. Ab Initio Crystal Structure Solution from X-ray Diffraction Data
Supplementary Materials
Author Contributions
Funding
Institutional Review Board Statement
Informed Consent Statement
Data Availability Statement
Acknowledgments
Conflicts of Interest
References
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Species | Symmetry | a, Å | b, Å | c, Å | α, ° | β, ° | γ, ° | V, Å3 |
---|---|---|---|---|---|---|---|---|
1′ | Triclinic | 10.12 | 10.68 | 10.36 | 73.3 | 88.0 | 60.0 | 920.7 |
2′ | Triclinic | 10.13 | 10.70 | 10.36 | 73.4 | 88.0 | 59.9 | 922.5 |
Compound | (1) | (2) |
---|---|---|
Formula | C33H36Cl3N3O18S6Tb2 | C33H36Cl3Eu2N3O18S6 |
Few | 1379.20 | 1365.28 |
Crystal color | Red | Red |
Sample size (mm3) | 0.02 × 0.04 × 0.07 | 0.02 × 8.0 × 10.0 |
Temperature (K) | 150 (2) | 298 (2) |
Wavelength (Å) | 1.54184 | 1.54184 |
Crystal system, Z | Monoclinic, 2 | Triclinic, 1 |
Space group | P21/n | P-1 |
a (Å) | 9.6868 (2) | 9.704 (1) |
b (Å) | 16.3511 (3) | 9.710 (1) |
c (Å) | 15.1558 (3) | 14.146 (1) |
α (°) | 90 | 84.003 (6) |
β (°) | 93.683 (2) | 97.145 (6) |
γ (°) | 90 | 78.526 (5) |
V (Å3) | 2395.57 (8) | 1284.6 (4) |
ρcalc (g.cm−3) | 1.912 | 1.764 |
μ(CuKα) (mm−1) | 18.94 | 19.92 |
θ range (°) | 3.981–73.587 | 2.5–52.5 |
Data collected | 19515 | 5001 |
Data unique | 4767 | - |
Data observed | 4408 | - |
Number of parameters/restraints | 388/65 | 58/9 |
R(int) | 0.0486 | - |
R1(F), a I > 2σ(I) | 0.0490 | (Rp) 0.0491 |
wR2(F2), b all data | 0.1253 | (Rwp) 0.0755 |
S(F2), c all data | 1.106 | 6.13 |
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Oggianu, M.; Abhervé, A.; Marongiu, D.; Quochi, F.; Galán-Mascarós, J.R.; Bertolotti, F.; Masciocchi, N.; Avarvari, N.; Mercuri, M.L. Terbium and Europium Chlorocyananilate-Based 2D Coordination Polymers. Molecules 2023, 28, 6453. https://doi.org/10.3390/molecules28186453
Oggianu M, Abhervé A, Marongiu D, Quochi F, Galán-Mascarós JR, Bertolotti F, Masciocchi N, Avarvari N, Mercuri ML. Terbium and Europium Chlorocyananilate-Based 2D Coordination Polymers. Molecules. 2023; 28(18):6453. https://doi.org/10.3390/molecules28186453
Chicago/Turabian StyleOggianu, Mariangela, Alexandre Abhervé, Daniela Marongiu, Francesco Quochi, José Ramón Galán-Mascarós, Federica Bertolotti, Norberto Masciocchi, Narcis Avarvari, and Maria Laura Mercuri. 2023. "Terbium and Europium Chlorocyananilate-Based 2D Coordination Polymers" Molecules 28, no. 18: 6453. https://doi.org/10.3390/molecules28186453