2-[(4-Methylbenzyl)Sulfanyl]-1,5,6,7-Tetrahydro-4H-Cyclopenta[D]Pyrimidin-4-One
Properties
| Property | Value |
|---|---|
| Formula | C15H16N2OS |
| IUPAC Name | 2-(p-tolylmethylsulfanyl)-6,7-dihydro-5h-cyclopenta[d]pyrimidin-4-one |
| Molecular Mass | 272.365 g·mol−1 |
| Heat of Formation | -41.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.17 ± 1.08 D |
| Volume | 323.64 Å 3 |
| Surface Area | 303.45 Å 2 |
| HOMO Energy | -8.89 ± 0.55 eV |
| LUMO Energy | 2.25 ± eV |
| Point Group Symmetry | C1 |
| Synonyms |
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| InChIKey | SEZPRMPVJMVCBV-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C S O N |