5-(4-Hydroxybenzoyl)-2,3-Dihydro-1H-Pyrrolizine-1-Carboxylic Acid

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Properties Simple | Detailed

Formula C15H13NO4
IUPAC Name (1s)-5-(4-hydroxybenzoyl)-2,3-dihydro-1h-pyrrolizin-4-ium-8-ylium-1-carboxylic acid
Molecular Mass 271.268 g·mol−1
Heat of Formation -473.2 ± 16.7 kJ·mol−1
Dipole Moment 1.43 ± 1.08 D
Volume 308.45 Å 3
Surface Area 283.91 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy -0.53 ± eV
Point Group Symmetry C1
InChIKey PIQMOWBWPFGZMW-NSHDSACASA-N
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