(2S)-2,3-Bis(Nitrooxy)Propyl Ethyl[(4S,6S)-6-Methyl-7,7-Dioxido-2-Sulfamoyl-5,6-Dihydro-4H-Thieno[2,3-B]Thiopyran-4-Yl]Carbamate
Properties
| Property | Value |
|---|---|
| Formula | C14H20N4O12S3 |
| IUPAC Name | [(2s)-2,3-dinitrooxypropyl] n-ethyl-n-[(4s,6s)-6-methyl-7,7-dioxo-2-sulfamoyl-5,6-dihydro-4h-thieno[2,3-b]thiopyran-4-yl]carbamate |
| Molecular Mass | 532.523 g·mol−1 |
| Heat of Formation | -1162.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 8.19 ± 1.08 D |
| Volume | 537.91 Å 3 |
| Surface Area | 449.92 Å 2 |
| HOMO Energy | -9.45 ± 0.55 eV |
| LUMO Energy | -1.77 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | RFISBOUXKIOATP-QXEWZRGKSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O N |