2-(5-Carbamimidoyl-2-Hydroxyphenoxy)-6-[3-(1H-Imidazol-2-Yl)Phenoxy]Isonicotinic Acid

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Properties Simple | Detailed

Formula C22H17N5O5
IUPAC Name 2-(5-carbamimidoyl-2-hydroxy-phenoxy)-6-(3-imidazol-2-ylphenoxy)pyridine-4-carboxylic acid
Molecular Mass 431.401 g·mol−1
Heat of Formation -263.4 ± 16.7 kJ·mol−1
Dipole Moment 8.90 ± 1.08 D
Volume 475.54 Å 3
Surface Area 432.11 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy 1.65 ± eV
Point Group Symmetry C1
InChIKey ILFWHJBPGCBXAY-UHFFFAOYSA-N
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