(3S,6R,9S,12S,14E,16R,18S)-6-(4-Hydroxy-3-Iodobenzyl)-3,7,9,12,14,16,18-Heptamethyl-1-Oxa-4,7,10-Triazacyclooctadec-14-Ene-2,5,8,11-Tetrone
Properties
Property | Value |
---|---|
Formula | C28H40IN3O6 |
IUPAC Name | (3s,6r,9s,12s,14e,16r,18s)-6-[(4-hydroxy-3-iodo-phenyl)methyl]-3,7,9,12,14,16,18-heptamethyl-1-oxa-4,7,10-triazacyclooctadec-14-ene-2,5,8,11-tetrone |
Molecular Mass | 641.538 g·mol−1 |
Heat of Formation | -1149.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.94 ± 1.08 D |
Volume | 701.34 Å 3 |
Surface Area | 502.07 Å 2 |
HOMO Energy | -8.94 ± 0.55 eV |
LUMO Energy | -0.38 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | QMYRWKWZINECMT-SVSKSJJFSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | I H C O N |