Methyl (1R,3R,4R,10S,14R,16Z,18R)-18-(Hydroxymethyl)-14-Methyl-15,19-Dioxo-12-Azapentacyclo[10.6.1.1~1,4~.0~7,20~.0~10,18~]Icosa-7(20),16-Diene-3-Carboxylate

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Formula C23H29NO5
IUPAC Name methyl (1r,3r,4r,10s,14r,16z,18r)-18-(hydroxymethyl)-14-methyl-15,19-dioxo-12-azapentacyclo[10.6.1.1 1,4 .0 7,20 .0 10,18 ]icosa-7(20),16-diene-3-carboxylate
Molecular Mass 399.480 g·mol−1
Heat of Formation -776.4 ± 16.7 kJ·mol−1
Dipole Moment 3.39 ± 1.08 D
Volume 459.94 Å 3
Surface Area 350.46 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 0.61 ± eV
Point Group Symmetry C1
InChIKey AFHHOCAMBXRKGP-PIHZIMBRSA-N
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