(3R,5R)-3,5-Bis(4-Chlorophenyl)-3-(1H-Imidazol-1-Ylmethyl)-2-Methyl-1,2-Oxazolidine

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Properties Simple | Detailed

Formula C20H19Cl2N3O
IUPAC Name (3r,5r)-3,5-bis(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-isoxazolidine
Molecular Mass 388.290 g·mol−1
Heat of Formation 222.5 ± 16.7 kJ·mol−1
Dipole Moment 4.27 ± 1.08 D
Volume 447.86 Å 3
Surface Area 362.97 Å 2
HOMO Energy -9.62 ± 0.55 eV
LUMO Energy -0.51 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,5r)-3,5-bis(4-chlorophenyl)-3-(1-imidazolylmethyl)-2-methylisoxazolidine
  • (3r,5r)-3,5-bis(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-1,2-oxazolidine
  • (3r,5r)-3,5-bis(4-chlorophenyl)-3-(imidazol-1-ylmethyl)-2-methyl-isoxazolidine
  • cis-3,5-bis(4-chlorophenyl)-3-((1h-imidazol-1-yl)-methyl)-2-methylisoxazolidine
  • isoxazolidine, 3,5-bis(4-chlorophenyl)-3-(1h-imidazol-1-ylmethyl)-2-methyl-, cis-
  • pr 967234
CAS Number(s)
  • 113614-50-9
InChIKey JQNRGBCRWDMIDS-UXHICEINSA-N
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Elements H C N O Cl