Methyl (3-Ethylidene-1,2,3,4,6,7,12,12B-Octahydroindolo[2,3-A]Quinolizin-2-Yl)(14-Ethyl-10-Oxa-8,16-Diazahexacyclo[11.5.2.1~1,8~.0~2,7~.0~12,21~.0~16,19~]Henicosa-2,4,6-Trien-9-Yl)Acetate

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Formula C40H48N4O3
IUPAC Name methyl (3-ethylidene-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl)(14-ethyl-10-oxa-8,16-diazahexacyclo[11.5.2.1 1,8 .0 2,7 .0 12,21 .0 16,19 ]henicosa-2,4,6-trien-9-yl)acetate
Molecular Mass 632.834 g·mol−1
Heat of Formation -185.8 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 762.57 Å 3
Surface Area 562.29 Å 2
HOMO Energy -8.16 ± 0.55 eV
LUMO Energy 0.14 ± eV
Point Group Symmetry C1
InChIKey ISDWYSGTYITCHG-FCAICYFCSA-N
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