6-(1H-Imidazol-1-Ylmethyl)-5,6,7,8-Tetrahydro-2-Naphthalenecarboxylic Acid

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Properties Simple | Detailed

Formula C15H16N2O2
IUPAC Name (2r)-2-(4h-imidazol-3-ium-4-ylium-3-ylmethyl)tetralin-6-carboxylic acid
Molecular Mass 256.300 g·mol−1
Heat of Formation -199.8 ± 16.7 kJ·mol−1
Dipole Moment 3.67 ± 1.08 D
Volume 312.96 Å 3
Surface Area 282.22 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
InChIKey VJJHOPPXRPHVCA-LLVKDONJSA-N
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