(16R)-19-Amino-13-Fluoro-3,5,8,16-Tetramethyl-17-Oxa-4,5,8,20-Tetraazatetracyclo[16.3.1.0~2,6~.0~10,15~]Docosa-1(22),2(6),3,10,12,14,18,20-Octaen-9-One
Properties
Property | Value |
---|---|
Formula | C21H22FN5O2 |
IUPAC Name | (16r)-19-amino-13-fluoro-3,5,8,16-tetramethyl-17-oxa-4,5,8,20-tetraazatetracyclo[16.3.1.0 2,6 .0 10,15 ]docosa-1(22),2(6),3,10,12,14,18,20-octaen-9-one |
Molecular Mass | 395.430 g·mol−1 |
Heat of Formation | -96.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.56 ± 1.08 D |
Volume | 450.9 Å 3 |
Surface Area | 364.29 Å 2 |
HOMO Energy | -8.20 ± 0.55 eV |
LUMO Energy | 2.42 ± eV |
Point Group Symmetry | C1 |
InChIKey | ASQDMAQHZGURLM-GFCCVEGCSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C F O N |