7-Chloro-11,17-Dioxa-2,4,20,22-Tetraazatricyclo[16.3.1.0~5,10~]Docosa-1(22),5,7,9,18,20-Hexaen-3-One
Properties
Property | Value |
---|---|
Formula | C16H17ClN4O3 |
IUPAC Name | 7-chloro-11,17-dioxa-2,4,20,22-tetrazatricyclo[16.3.1.05,10]docosa-1(21),5(10),6,8,18(22),19-hexaen-3-one |
Molecular Mass | 348.784 g·mol−1 |
Heat of Formation | -285.6 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.11 ± 1.08 D |
Volume | 380.33 Å 3 |
Surface Area | 328.77 Å 2 |
HOMO Energy | -8.64 ± 0.55 eV |
LUMO Energy | -0.93 ± eV |
Point Group Symmetry | C1 |
InChIKey | JRSWWYITYIOHOP-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O Cl |