Methyl (1R,9R,12R,21R)-15,20-Dioxo-19-Oxa-8,16-Diazahexacyclo[10.6.4.0~1,9~.0~2,7~.0~9,21~.0~12,16~]Docosa-2,4,6,13-Tetraene-8-Carboxylate
Properties
Property | Value |
---|---|
Formula | C21H20N2O5 |
IUPAC Name | methyl (1r,9r,12r,21r)-15,20-dioxo-19-oxa-8,16-diazahexacyclo[10.6.4.0 1,9 .0 2,7 .0 9,21 .0 12,16 ]docosa-2,4,6,13-tetraene-8-carboxylate |
Molecular Mass | 380.394 g·mol−1 |
Heat of Formation | -603.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.40 ± 1.08 D |
Volume | 415.89 Å 3 |
Surface Area | 334.27 Å 2 |
HOMO Energy | -9.14 ± 0.55 eV |
LUMO Energy | -0.38 ± eV |
Point Group Symmetry | C1 |
InChIKey | STACHDUHGOCYFP-RKTMXUFFSA-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 |