1-[(1R,13S)-4,6-Dimethoxy-12-Oxo-11,17-Diazatetracyclo[11.3.1.0~2,11~.0~3,8~]Heptadeca-3,5,7-Trien-17-Yl]-2-(3,4,5-Trimethoxyphenyl)-1,2-Ethanedione

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Formula C28H32N2O8
IUPAC Name 1-[(1r,2r,13s)-4,6-dimethoxy-12-oxo-11,17-diazatetracyclo[11.3.1.0 2,11 .0 3,8 ]heptadeca-3,5,7-trien-17-yl]-2-(3,4,5-trimethoxyphenyl)-1,2-ethanedione
Molecular Mass 524.562 g·mol−1
Heat of Formation -1079.2 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 601.43 Å 3
Surface Area 465.64 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy 2.28 ± eV
Point Group Symmetry C1
InChIKey ODLXCGSAEOWAKV-IMWIBFENSA-N
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