(3R,6S,9R,12S)-19-(2-Hexanyl)-9-Isobutyl-3,12-Diisopropyl-6-Methyl-1-Oxa-4,7,10,13,16-Pentaazacyclononadecane-2,5,8,11,14,17-Hexone
Properties
Property | Value |
---|---|
Formula | C30H53N5O7 |
IUPAC Name | 9-isobutyl-3,12-diisopropyl-6-methyl-19-(1-methylpentyl)-1-oxa-4,7,10,13,16-pentazacyclononadecane-2,5,8,11,14,17-hexone |
Molecular Mass | 595.771 g·mol−1 |
Heat of Formation | -1685.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.77 ± 1.08 D |
Volume | 801.29 Å 3 |
Surface Area | 592.3 Å 2 |
HOMO Energy | -9.63 ± 0.55 eV |
LUMO Energy | 0.84 ± eV |
Point Group Symmetry | C1 |
InChIKey | DSWZWPQYGALTJZ-DULFJFJWSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |