(2E,4E)-1-{(2S,6R,14R,22R,25S)-25-[(2R)-3,3-Dimethyl-2-Oxiranyl]-1,3,13,15-Tetraazaheptacyclo[18.4.1.0~2,6~.0~6,22~.0~7,12~.0~14,22~.0~16,21~]Pentacosa-7,9,11,16,18,20-Hexaen-3-Yl}-2,4-Hexadien-1-One

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Formula C31H34N4O2
IUPAC Name (2e,4e)-1-{(2s,6r,14r,22r,25s)-25-[(2r)-3,3-dimethyl-2-oxiranyl]-1,3,13,15-tetraazaheptacyclo[18.4.1.0 2,6 .0 6,22 .0 7,12 .0 14,22 .0 16,21 ]pentacosa-7,9,11,16,18,20-hexaen-3-yl}-2,4-hexadien-1-one
Molecular Mass 494.627 g·mol−1
Heat of Formation 108.3 ± 16.7 kJ·mol−1
Dipole Moment 2.88 ± 1.08 D
Volume 597.01 Å 3
Surface Area 459.71 Å 2
HOMO Energy -8.28 ± 0.55 eV
LUMO Energy 2.74 ± eV
Point Group Symmetry C1
InChIKey NGWRTMWKLOPVRM-SNBYXLDTSA-N
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