(3S)-3-(Benzoyloxy)-4-Cyanobutanoic Acid

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Properties Simple | Detailed

Formula C12H11NO4
IUPAC Name (3r)-3-benzoyloxy-4-cyano-butanoic acid
Molecular Mass 233.220 g·mol−1
Heat of Formation -551.3 ± 16.7 kJ·mol−1
Dipole Moment 4.33 ± 1.08 D
Volume 275.35 Å 3
Surface Area 254.84 Å 2
HOMO Energy -10.32 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey GKWZKZVNTLJRFP-SNVBAGLBSA-N
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