(2Z)-2-Ethylidene-8-Hydroxy-7,11-Dimethoxy-1,2,3,10,11,11A-Hexahydro-5H-Pyrrolo[2,1-C][1,4]Benzodiazepin-5-One
Properties
| Property | Value |
|---|---|
| Formula | C16H20N2O4 |
| IUPAC Name | (6r,6as,8z)-8-ethylidene-3-hydroxy-2,6-dimethoxy-6,6a,7,9-tetrahydro-5h-pyrrolo[2,1-c][1,4]benzodiazepin-11-one |
| Molecular Mass | 304.341 g·mol−1 |
| Heat of Formation | -532.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.41 ± 1.08 D |
| Volume | 360.41 Å 3 |
| Surface Area | 315.61 Å 2 |
| HOMO Energy | -8.53 ± 0.55 eV |
| LUMO Energy | -0.00 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UQVNRKBFAXNOGA-OHLDGCSVSA-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 |