N-[(1-{[(3E,9E)-5-Isopropyl-2,7-Dioxo-1,6-Diazacyclododeca-3,9-Dien-8-Yl]Amino}-3-Methyl-1-Oxo-2-Butanyl)Carbamoyl]Valine
Properties
Property | Value |
---|---|
Formula | C24H39N5O6 |
IUPAC Name | (2r)-2-[[(1r)-1-[[(3e,5r,8r,9z)-5-isopropyl-2,7-dioxo-1,6-diazacyclododeca-3,9-dien-8-yl]carbamoyl]-2-methyl-propyl]carbamoylamino]-3-methyl-butanoic acid |
Molecular Mass | 493.596 g·mol−1 |
Heat of Formation | -1204.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.17 ± 1.08 D |
Volume | 624.89 Å 3 |
Surface Area | 492.8 Å 2 |
HOMO Energy | -9.63 ± 0.55 eV |
LUMO Energy | 0.23 ± eV |
Point Group Symmetry | C1 |
InChIKey | RUWSLQOIGKYPEZ-XDIRUBDBSA-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 |