(1R,2R,12R,13S,16Z)-25-(9H-β-Carbolin-1-Yl)-13-Hydroxy-11,22-Diazapentacyclo[11.11.2.1~2,22~.0~2,12~.0~4,11~]Heptacosa-16,25-Dien-7-One

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Formula C36H61N4O2
IUPAC Name carbon; (1e,3e)-n-[(z)-hex-3-enyl]-n-methyl-5-methylene-1-(4-phenyl-3h-pyridin-1-ium-2-yl)hepta-1,3-dien-4-amine; hydron; (1z,3z,5z)-n-methylhepta-1,3,5-trien-1-amine; nitrogen; hydroxide; hydrate
Molecular Mass 597.014 g·mol−1
Heat of Formation 3507.8 ± 16.7 kJ·mol−1
Dipole Moment 5.45 ± 1.08 D
Volume 533.73 Å 3
Surface Area 422.1 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy -2.89 ± eV
Point Group Symmetry C1
InChIKey LTHULOBARTYAMF-UOVIKJRVSA-N
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