(2R)-2-[3-Chloro-4-(2,5-Dihydro-1H-Pyrrol-1-Yl)Phenyl]Propanoic Acid

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Properties Simple | Detailed

Formula C13H14ClNO2
IUPAC Name (2r)-2-[3-chloro-4-(2,5-dihydropyrrol-1-yl)phenyl]propanoic acid
Molecular Mass 251.709 g·mol−1
Heat of Formation -214.8 ± 16.7 kJ·mol−1
Dipole Moment 2.96 ± 1.08 D
Volume 294.35 Å 3
Surface Area 267.78 Å 2
HOMO Energy -8.19 ± 0.55 eV
LUMO Energy -0.23 ± eV
Point Group Symmetry C1
InChIKey PIDSZXPFGCURGN-SECBINFHSA-N
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Elements H C N O Cl