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

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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
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