N-{[(1R,2S,10R,13S)-12-Cyano-7,18-Dimethoxy-6,17,21-Trimethyl-5,8,16,19-Tetraoxo-11,21-Diazapentacyclo[11.7.1.0~2,11~.0~4,9~.0~15,20~]Henicosa-4(9),6,15(20),17-Tetraen-10-Yl]Methyl}-2-Hydroxy-2-Methyl-4-Oxopentanamide

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Formula C32H36N4O9
IUPAC Name n-{[(1r,2s,10r,13s)-12-cyano-7,18-dimethoxy-6,17,21-trimethyl-5,8,16,19-tetraoxo-11,21-diazapentacyclo[11.7.1.0 2,11 .0 4,9 .0 15,20 ]henicosa-4(9),6,15(20),17-tetraen-10-yl]methyl}-2-hydroxy-2-methyl-4-oxopentanamide
Molecular Mass 620.650 g·mol−1
Heat of Formation -1095.2 ± 16.7 kJ·mol−1
Dipole Moment 1.49 ± 1.08 D
Volume 717.37 Å 3
Surface Area 518.34 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy -1.99 ± eV
Point Group Symmetry C1
InChIKey PYOFDRKUKHPATO-WXMZNYOCSA-N
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