Dimethyl (16S)-16-Hydroxy-21-Oxo-2,12-Diazapentacyclo[14.2.2.1~9,12~.0~1,9~.0~3,8~]Henicosa-3,5,7,17-Tetraene-2,18-Dicarboxylate
Properties
Property | Value |
---|---|
Formula | C23H26N2O6 |
IUPAC Name | dimethyl (1s,9s)-16-hydroxy-21-oxo-2,12-diazapentacyclo[14.2.2.1 9,12 .0 1,9 .0 3,8 ]henicosa-3,5,7,17-tetraene-2,18-dicarboxylate |
Molecular Mass | 426.462 g·mol−1 |
Heat of Formation | -885.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.02 ± 1.08 D |
Volume | 478.96 Å 3 |
Surface Area | 359.27 Å 2 |
HOMO Energy | -8.65 ± 0.55 eV |
LUMO Energy | -0.39 ± eV |
Point Group Symmetry | C1 |
InChIKey | CTDOYMUKENYJJU-YTFSRNRJSA-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 |