4-(2-Bromo-4,5-Dimethoxybenzyl)-4-(2-{2-[(1R,2S,5R)-6,6-Dimethylbicyclo[3.1.1]Hept-2-Yl]Ethoxy}Ethyl)Morpholin-4-Ium

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Formula C26H41BrNO4+
IUPAC Name 4-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-4-[2-[2-(6,6-dimethylnorpinan-2-yl)ethoxy]ethyl]morpholin-4-ium
Molecular Mass 511.512 g·mol−1
Heat of Formation 3092.6 ± 16.7 kJ·mol−1
Dipole Moment 0.86 ± 1.08 D
Volume 523.15 Å 3
Surface Area 428.86 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -2.21 ± eV
Point Group Symmetry C1
InChIKey DDHUTBKXLWCZCO-KSEOMHKRSA-N
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Elements C Br O N