3-(3-Isocyanocyclopent-2-Enylidene)Propionic Acid

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Properties Simple | Detailed

Formula C9H10NO2
IUPAC Name (3z)-3-(3-isocyanocyclopent-2-en-1-ylidene)propanoic acid
Molecular Mass 164.181 g·mol−1
Heat of Formation -122.4 ± 16.7 kJ·mol−1
Dipole Moment 1.19 ± 1.08 D
Volume 206.02 Å 3
Surface Area 209.74 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
Synonyms
  • (3z)-3-(3-isocyano-1-cyclopent-2-enylidene)propanoic acid
  • (3z)-3-(3-isocyano-1-cyclopent-2-enylidene)propionic acid
InChIKey SBHNPHNIVBXIMQ-CLTKARDFSA-N
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