(5R)-5-(3-Aminopropyl)-1-Propyl-4,5,6,7-Tetrahydro-1H-Benzimidazole-5-Carboxylic Acid

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Properties Simple | Detailed

Formula C14H23N3O2
IUPAC Name (5r)-5-(3-aminopropyl)-1-propyl-6,7-dihydro-4h-benzimidazol-1-ium-3a-ylium-5-carboxylic acid
Molecular Mass 265.351 g·mol−1
Heat of Formation -378.7 ± 16.7 kJ·mol−1
Dipole Moment 6.25 ± 1.08 D
Volume 341.99 Å 3
Surface Area 301.4 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy 0.39 ± eV
Point Group Symmetry C1
InChIKey DPDWQELEXVLQSO-CQSZACIVSA-N
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