3-[(14R)-10-Chloro-14-Methyl-20,21-Diaza-23,24-Diazoniatetracyclo[Blah.Blah.Blah.Blah.Blah]Hexadeca-2(4),3(9),8(24),10,12(21),13(23),16(20)-Heptaen-16-Yl]-5-Cyclopropyl-1-Oxa-4-Azonia-2-Azanidacyclopenta-3,4-Diene
Properties
| Property | Value |
|---|---|
| Formula | C18H17ClN6O+++ |
| IUPAC Name | 3-[(14r)-10-chloro-14-methyl-20,21-diaza-23,24-diazoniatetracyclo[blah.blah.blah.blah.blah]hexadeca-2(4),3(9),8(24),10,12(21),13(23),16(20)-heptaen-16-yl]-5-cyclopropyl-1-oxa-4-azonia-2-azanidacyclopenta-3,4-diene |
| Molecular Mass | 368.820 g·mol−1 |
| Heat of Formation | 543.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.04 ± 1.08 D |
| Volume | 403.79 Å 3 |
| Surface Area | 346.46 Å 2 |
| HOMO Energy | -8.52 ± 0.55 eV |
| LUMO Energy | 0.83 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NXQIKWOAGPHNDR-JHVFGEPBSA-P |
| QR Code | Generate QR Code |
| Links | |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C N O Cl |