(10R)-10-Methyl-3-(6-Methyl-3-Pyridinyl)-9,10,11,12-Tetrahydro-8H-[1,4]Diazepino[5',6':4,5]Thieno[3,2-F]Quinolin-8-One
Properties
Property | Value |
---|---|
Formula | C21H18N4OS |
IUPAC Name | (15r)-15-methyl-5-(6-methyl-3-pyridyl)-11-thia-6,14,17-triazatetracyclo[8.8.02,7.012,18]octadeca-1(10),2(7),3,5,8,12(18)-hexaen-13-one |
Molecular Mass | 374.459 g·mol−1 |
Heat of Formation | 202.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.79 ± 1.08 D |
Volume | 422.19 Å 3 |
Surface Area | 374.29 Å 2 |
HOMO Energy | -8.17 ± 0.55 eV |
LUMO Energy | -1.65 ± eV |
Point Group Symmetry | C1 |
InChIKey | CMWRPDHVGMHLSZ-GFCCVEGCSA-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 |