(3S)-N-(5-Chloro-2-Methylphenyl)-1-Cyclohexyl-5-Oxo-3-Pyrrolidinecarboxamide

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Properties Simple | Detailed

Formula C18H23ClN2O2
IUPAC Name (3s)-n-(5-chloro-2-methyl-phenyl)-1-cyclohexyl-5-oxo-pyrrolidine-3-carboxamide
Molecular Mass 334.840 g·mol−1
Heat of Formation -417.1 ± 16.7 kJ·mol−1
Dipole Moment 7.75 ± 1.08 D
Volume 404.66 Å 3
Surface Area 352.64 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy 2.61 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-n-(5-chloro-2-methyl-phenyl)-1-cyclohexyl-5-keto-pyrrolidine-3-carboxamide
  • (3s)-n-(5-chloro-2-methyl-phenyl)-1-cyclohexyl-5-oxo-pyrrolidine-3-carboxamide
  • (3s)-n-(5-chloro-2-methylphenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
InChIKey RJWMDETWDDESBP-ZDUSSCGKSA-N
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Elements H C Cl O N