(3S)-N-(3-Bromophenyl)-1-Cyclohexyl-5-Oxo-3-Pyrrolidinecarboxamide

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Properties Simple | Detailed

Formula C17H21BrN2O2
IUPAC Name (3s)-n-(3-bromophenyl)-1-cyclohexyl-5-oxo-pyrrolidine-3-carboxamide
Molecular Mass 365.265 g·mol−1
Heat of Formation -327.9 ± 16.7 kJ·mol−1
Dipole Moment 2.84 ± 1.08 D
Volume 385.04 Å 3
Surface Area 340.14 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy 2.56 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-n-(3-bromophenyl)-1-cyclohexyl-5-keto-pyrrolidine-3-carboxamide
  • (3s)-n-(3-bromophenyl)-1-cyclohexyl-5-oxo-pyrrolidine-3-carboxamide
  • (3s)-n-(3-bromophenyl)-1-cyclohexyl-5-oxopyrrolidine-3-carboxamide
InChIKey MVPIURCUINFSAB-LBPRGKRZSA-N
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Elements H C Br O N