100 results (register for free to see all 40935 materials)
| ID (OMDB) ⇅ | ID (COD) ⇅ | Formula ⇅ | Space group H-M ⇅ | Space group IT ⇅ | Publication details | Publisher ↑ |
|---|---|---|---|---|---|---|
| 36980 | 2010756 | C11 H13 N O3 | P 21 21 21 | 19 | N-Acetyl-L-phenylalanine | Acta Crystallographica Section C, 2000, vol: 56, page: e100 |
| 12590 | 2235621 | C16 H16 N2 O4 | P -1 | 2 | Butane-1,4-diyl bis(pyridine-3-carboxylate) | Acta Crystallographica Section E, 2012, vol: 68, page: o2007 |
| 19840 | 2207459 | C3 H10 As I | P n m a | 62 | Trimethylarsonium iodide | Acta Crystallographica Section E, 2005, vol: 61, page: o4229 |
| 19941 | 2215126 | C13 H14 O S | P -1 | 2 | 3-Butyl-1H-isochromene-1-thione | Acta Crystallographica Section E, 2007, vol: 63, page: o3708 |
| 19996 | 2219137 | C7 H14 N4 O3 | P -1 | 2 | 4,6-Dimethylpyrimidin-2(1H)-one--urea--water (1/1/1) | Acta Crystallographica Section E, 2008, vol: 64, page: o1488 |
| 20218 | 2240794 | C14 H9 Br4 N | P 1 21 1 | 4 | Crystal structure of 1,3,6,8-tetrabromo-9-ethyl-9H-carbazole | Acta Crystallographica Section E, 2015, vol: 71, page: o373 |
| 22196 | 2222329 | C6 H7 N3 O2 | P 1 21/n 1 | 14 | 4-Methyl-3-nitropyridin-2-amine | Acta Crystallographica Section E, 2009, vol: 65, page: o1615 |
| 22620 | 2221205 | C8 H5 Cl N2 | P 1 21/n 1 | 14 | 2-Chloroquinoxaline | Acta Crystallographica Section E, 2009, vol: 65, page: o455 |
| 22935 | 2230093 | C15 H15 Hf | P 63/m | 176 | Tris(\h^5^-cyclopentadienyl)hafnium(III) | Acta Crystallographica Section E, 2011, vol: 67, page: m629 |
| 23663 | 2217577 | C8 H5 N3 O3 | P 1 21/n 1 | 14 | 7-Nitroquinazolin-4(3H)-one | Acta Crystallographica Section E, 2008, vol: 64, page: o427 |
Is your relevant material missing?
- We can share our experience running high-throughput calculations based on density functional theory.
- Alternatively, our machine learning models trained on our large database can predict relevant material properties.
Feel free to contact us if you are interested in a partnership so that we can provide computationally relevant results.
Please email us at: