(2E,11As)-2-Ethylidene-1,2,3,11A-Tetrahydro-5H-Pyrrolo[2,1-C][1,4]Benzodiazepin-5-One
Properties
Property | Value |
---|---|
Formula | C14H14N2O |
IUPAC Name | (6ar,8z)-8-ethylidene-7,9-dihydro-6ah-pyrrolo[2,1-c][1,4]benzodiazepin-11-one |
Molecular Mass | 226.274 g·mol−1 |
Heat of Formation | 67.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.03 ± 1.08 D |
Volume | 273.94 Å 3 |
Surface Area | 252.88 Å 2 |
HOMO Energy | -9.23 ± 0.55 eV |
LUMO Energy | -0.69 ± eV |
Point Group Symmetry | C1 |
InChIKey | GYUDGZRJHSDPLH-ACHGEACHSA-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 |