Methyl (1S,6R)-4-[(4-Chlorophenyl)Amino]-6-Methyl-2-Oxo-3-Cyclohexene-1-Carboxylate

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Properties Simple | Detailed

Formula C15H16ClNO3
IUPAC Name methyl (1s,6r)-4-(4-chloroanilino)-6-methyl-2-oxo-cyclohex-3-ene-1-carboxylate
Molecular Mass 293.745 g·mol−1
Heat of Formation -446.8 ± 16.7 kJ·mol−1
Dipole Moment 5.75 ± 1.08 D
Volume 339.69 Å 3
Surface Area 306.05 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy 2.30 ± eV
Point Group Symmetry C1
InChIKey XFETUZOSYZRHMX-OTYXRUKQSA-N
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Elements H C N O Cl