12,13,14,14A-Tetrahydro-9H,11H-Pyrazino[2,1-C]Pyrrolo[1,2-A][1,4]Benzodiazepine
Properties
Property | Value |
---|---|
Formula | C15H17N3 |
IUPAC Name | (7s,12r)-2,9,12-triazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,5,14,16-pentaene |
Molecular Mass | 239.316 g·mol−1 |
Heat of Formation | 304.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.39 ± 1.08 D |
Volume | 292.8 Å 3 |
Surface Area | 255.1 Å 2 |
HOMO Energy | -8.52 ± 0.55 eV |
LUMO Energy | -0.21 ± eV |
Point Group Symmetry | C1 |
InChIKey | HYVNCVDAKNYUHU-HNNXBMFYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N |