4-[3-Amino-6-(3,4,5-Trimethoxyphenyl)-2-Pyrazinyl]-2-Ethoxybenzoic Acid

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Properties Simple | Detailed

Formula C22H23N3O6
IUPAC Name 4-[3-amino-6-(3,4,5-trimethoxyphenyl)pyrazin-2-yl]-2-ethoxy-benzoic acid
Molecular Mass 425.435 g·mol−1
Heat of Formation -657.5 ± 16.7 kJ·mol−1
Dipole Moment 3.77 ± 1.08 D
Volume 485.57 Å 3
Surface Area 440.53 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
InChIKey MVWFAKKKMGICFP-UHFFFAOYSA-N
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