3-(Aminomethyl)-9-Methoxy-1,2,3,4-Tetrahydro-5H-[1]Benzothieno[3,2-E][1,4]Diazepin-5-One
Properties
| Property | Value |
|---|---|
| Formula | C13H15N3O2S |
| IUPAC Name | (3r)-3-(aminomethyl)-9-methoxy-1,2,3,4-tetrahydrobenzothiopheno[3,2-e][1,4]diazepin-5-one |
| Molecular Mass | 277.342 g·mol−1 |
| Heat of Formation | -133.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.72 ± 1.08 D |
| Volume | 311.09 Å 3 |
| Surface Area | 284.77 Å 2 |
| HOMO Energy | -7.80 ± 0.55 eV |
| LUMO Energy | 2.16 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | TXYKBKYDFZQOCB-SSDOTTSWSA-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 |