6-Chloro-2,3-Dihydroxy-7,8-Dimethoxy-10,20-Dimethyl-16,17,18-Trithia-10,12,20-Triazapentacyclo[12.4.2.0~1,12~.0~3,11~.0~4,9~]Icosa-4,6,8-Triene-13,19-Dione
Properties
Property | Value |
---|---|
Formula | C18H20ClN3O6S3 |
IUPAC Name | (1s,2r,3s,11r,14r)-6-chloro-2,3-dihydroxy-7,8-dimethoxy-10,20-dimethyl-16,17,18-trithia-10,12,20-triazapentacyclo[12.4.2.0 1,12 .0 3,11 .0 4,9 ]icosa-4,6,8-triene-13,19-dione |
Molecular Mass | 506.016 g·mol−1 |
Heat of Formation | -826.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.80 ± 1.08 D |
Volume | 512.55 Å 3 |
Surface Area | 382.66 Å 2 |
HOMO Energy | -8.41 ± 0.55 eV |
LUMO Energy | 1.41 ± eV |
Point Group Symmetry | C1 |
InChIKey | VUWFDUNAWUUIJJ-VYOAHBHTSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C Cl H O N S |