Crystallography Open Database
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Result: there are 96 entries in the selection
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Searching journal of publication like 'Journal of Molecular Structure'
COD ID  |
Links | Formula  |
Space group |
Cell parameters | Cell volume |
Bibliography |
|---|---|---|---|---|---|---|
| 1559915 | CIF | C34.82 H25.85 Fe2 N16.96 O | C 1 2/m 1 | 19.908; 14.944; 12.194 90; 91.379; 90 | 3627 | Setifi, Zouaoui; Geiger, David; Jelsch, Christian; Maris, Thierry; Glidewell, Christopher; Mirzaei, Masoud; Arefian, Mina; Setifi, Fatima The first Fe(II) complex bearing end-to-end dicyanamide as a double bridging ligand: Crystallography study and Hirshfeld surface analysis; completed with a CSD survey Journal of Molecular Structure, 2018, 1173, 697-706 |
| 1559916 | CIF | C16 H12 Fe N8 | C 1 2/c 1 | 7.427; 16.682; 13.601 90; 96.413; 90 | 1674.6 | Setifi, Zouaoui; Geiger, David; Jelsch, Christian; Maris, Thierry; Glidewell, Christopher; Mirzaei, Masoud; Arefian, Mina; Setifi, Fatima The first Fe(II) complex bearing end-to-end dicyanamide as a double bridging ligand: Crystallography study and Hirshfeld surface analysis; completed with a CSD survey Journal of Molecular Structure, 2018, 1173, 697-706 |
| 1565987 | CIF HKL | C26 H32 N4 O8 Zn | P -1 | 8.4854; 8.9023; 10.1517 68.874; 65.755; 77.396 | 650 | Dissem, Nour; Ferhi, Najmeddine; Maris, Thierry; Duong, Adam Design, structural characterization and Hirshfeld surface analysis of Ni(II) and Zn(II) coordination polymers using mixed linker synthetic strategy based on tetratopic and macrocyclic N-donor ligands Journal of Molecular Structure, 2022, 1254, 132317 |
| 1565988 | CIF HKL | C36 H54 N8 Ni2 O8 | P -1 | 8.1759; 10.9024; 11.1088 98.356; 99.482; 100.719 | 943.68 | Dissem, Nour; Ferhi, Najmeddine; Maris, Thierry; Duong, Adam Design, structural characterization and Hirshfeld surface analysis of Ni(II) and Zn(II) coordination polymers using mixed linker synthetic strategy based on tetratopic and macrocyclic N-donor ligands Journal of Molecular Structure, 2022, 1254, 132317 |
| 1565989 | CIF HKL | C32 H36 N4 Ni O8 | P -1 | 8.7501; 9.4842; 10.6727 70.743; 68.904; 80.513 | 779.04 | Dissem, Nour; Ferhi, Najmeddine; Maris, Thierry; Duong, Adam Design, structural characterization and Hirshfeld surface analysis of Ni(II) and Zn(II) coordination polymers using mixed linker synthetic strategy based on tetratopic and macrocyclic N-donor ligands Journal of Molecular Structure, 2022, 1254, 132317 |
| 1565990 | CIF HKL | C37 H49 N6 O9 Zn1.5 | P -1 | 9.8822; 10.8076; 19.0586 91.26; 99.324; 111.144 | 1866.23 | Dissem, Nour; Ferhi, Najmeddine; Maris, Thierry; Duong, Adam Design, structural characterization and Hirshfeld surface analysis of Ni(II) and Zn(II) coordination polymers using mixed linker synthetic strategy based on tetratopic and macrocyclic N-donor ligands Journal of Molecular Structure, 2022, 1254, 132317 |
| 1572854 | CIF HKL | C32 H34 N4 O9 S3 | P -1 | 11.2834; 13.3905; 13.4806 113.251; 105.083; 98.375 | 1734.64 | Mulholland, Michael E.; Filiatrault, Heather L.; Maris, Thierry; Skene, W. G. Structural study of an electroactive allyl ester thiophenoazomethine for PDMS blending Journal of Molecular Structure, 2025, 1320, 139416-1-139416-8 |
| 5000149 | CIF | C6 H3 N3 O6 | P c a 21 | 14.065; 5.67; 9.896 90; 90; 90 | 789.19 | Laerdahl, Jon K.; Fægri, Knut; Rømming, Christian; Swang, Ole; Midtgård, Tonje; Schöffel, Klaus Substituent crowding in nitrobenzenes Journal of Molecular Structure, 1998, 445, 89-98 |
| 5000156 | CIF | C H6 N4 O3 | C 1 m 1 | 12.706; 7.26; 3.6077 90; 121.01; 90 | 285.23 | Katrusiak, A.; Szafrański, M. Structural phase transitions in guanidinium nitrate Journal of Molecular Structure, 1996, 378, 205-223 |
| 5000159 | CIF | C8 H18 O2 | P 1 21/n 1 | 8.181; 11.833; 10.392 90; 100.17; 90 | 990.2 | Slovokhotov, Yu. L.; Timofeeva, T. V.; Antipin, M. Yu.; Struchkov, Yu. T. Distortion of "tetrahedral" C~3v~ coordination in the R~3~C‒O moiety due to the reduction of molecular symmetry: X-ray, conformational, and quantum-chemical study Journal of Molecular Structure, 1984, 112, 127-140 |
| 5000199 | CIF | C3 H6 O3 | P 21 21 21 | 5.4896; 8.4221; 9.3453 90; 90; 90 | 432.07 | Schouten, A.; Kanters, J. A.; van Krieken, J. Low temperature crystal structure and molecular conformation of L-(+)-lactic acid Journal of Molecular Structure, 1994, 323, 165-168 |
| 6000130 | CIF | C8 D10 | P b c a | 10.155; 7.4649; 16.8814 90; 90; 90 | 1279.71 | Ibberson, R. M.; David, W. I. F.; Parsons, S.; Prager, M.; Shankland, K. The crystal structures of m-xylene and p-xylene, C8D10, at 4.5 k Journal of Molecular Structure, 2000, 524, 121-128 |
| 6000131 | CIF | C8 D10 | P 1 21/n 1 | 5.7337; 4.9485; 11.1385 90; 100.713; 90 | 310.53 | Ibberson, R. M.; David, W. I. F.; Parsons, S.; Prager, M.; Shankland, K. The crystal structures of m-xylene and p-xylene, C8D10, at 4.5 k Journal of Molecular Structure, 2000, 524, 121-128 |
| 6000383 | CIF | C3 H10 O8 P2 Zr | P n a 21 | 30.212; 6.6128; 5.3612 90; 90; 90 | 1071.09 | Alberti, G.; Vivani, R.; Mascaros, S. M. First structural determination of layered and pillared organic derivatives of gamma-zirconium phosphate by X-ray powder diffraction data Journal of Molecular Structure, 1998, 470, 81-92 |
| 6000384 | CIF | C3 H10 O8 P2 Zr | P 1 21/c 1 | 5.3593; 6.6217; 30.695 90; 98.81; 90 | 1076.44 | Alberti, G.; Vivani, R.; Mascaros, S. M. First structural determination of layered and pillared organic derivatives of gamma-zirconium phosphate by X-ray powder diffraction data Journal of Molecular Structure, 1998, 470, 81-92 |
| 6000385 | CIF | C2 H7 O8 P2 Zr | P m m n | 5.3797; 6.6244; 13.0111 90; 90; 90 | 463.68 | Alberti, G.; Vivani, R.; Mascaros, S. M. First structural determination of layered and pillared organic derivatives of gamma-zirconium phosphate by X-ray powder diffraction data Journal of Molecular Structure, 1998, 470, 81-92 |
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