4-Methyl-1H-Pyrimido[4,5-B][1,5]Benzodiazepine-2,5-Dione
Properties
| Property | Value |
|---|---|
| Formula | C12H8N4O2 |
| IUPAC Name | 2-hydroxy-4-methyl-pyrimido[5,4-c][1,5]benzodiazepin-5-one |
| Molecular Mass | 240.218 g·mol−1 |
| Heat of Formation | 131.9 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.83 ± 1.08 D |
| Volume | 258.15 Å 3 |
| Surface Area | 242.37 Å 2 |
| HOMO Energy | -10.04 ± 0.55 eV |
| LUMO Energy | 0.80 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | ILYOWFONKJBUCA-UHFFFAOYSA-O |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |