(4-Chlorophenyl){4-[4-(4,5-Dihydro-1,3-Oxazol-2-Yl)Benzylidene]-1-Piperidinyl}Methanone

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Properties Simple | Detailed

Formula C22H21ClN2O2
IUPAC Name (4-chlorophenyl)-[4-[[4-(4,5-dihydrooxazol-2-yl)phenyl]methylene]-1-piperidyl]methanone
Molecular Mass 380.867 g·mol−1
Heat of Formation -78.6 ± 16.7 kJ·mol−1
Dipole Moment 3.50 ± 1.08 D
Volume 447.57 Å 3
Surface Area 390.87 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
Synonyms
  • (4-chloro-phenyl)-{4-[4-(4,5-dihydro-oxazol-2-yl)-benzylidene]-piperidin-1-yl}-methanone
  • (4-chlorophenyl)-[4-[4-(4,5-dihydrooxazol-2-yl)benzylidene]-1-piperidyl]methanone
  • (4-chlorophenyl)-[4-[[4-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]methylidene]piperidin-1-yl]methanone
  • (4-chlorophenyl)-[4-[[4-(4,5-dihydrooxazol-2-yl)phenyl]methylene]-1-piperidinyl]methanone
InChIKey JQNWPWUJMRAASQ-UHFFFAOYSA-N
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Elements H C N O Cl