(8R,11S)-8-Benzyl-11-Sec-Butyl-10,11-Dihydro-6H-Oxepino[2,3-D]Pyrazino[1,2-A]Pyrimidine-6,9(8H)-Dione
Properties
| Property | Value |
|---|---|
| Formula | C22H23N3O3 |
| IUPAC Name | (8r,11s)-8-benzyl-11-sec-butyl-10,11-dihydro-6h-oxepino[2,3-d]pyrazino[1,2-a]pyrimidine-6,9(8h)-dione |
| Molecular Mass | 377.436 g·mol−1 |
| Heat of Formation | -206.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.54 ± 1.08 D |
| Volume | 450.73 Å 3 |
| Surface Area | 377.34 Å 2 |
| HOMO Energy | -8.85 ± 0.55 eV |
| LUMO Energy | -1.18 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UOBOWSHNMYJJFQ-OLMNPRSZSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |