[5-(2-Methyl-2-Propanyl)-1,3,4-Oxadiazol-2-Yl][(2S)-2-Pyrrolidinyl]Methanone

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Properties Simple | Detailed

Formula C11H17N3O2
IUPAC Name (5-tert-butyl-1,3,4-oxadiazol-2-yl)-[(2s)-pyrrolidin-2-yl]methanone
Molecular Mass 223.272 g·mol−1
Heat of Formation -161.4 ± 16.7 kJ·mol−1
Dipole Moment 1.87 ± 1.08 D
Volume 278.73 Å 3
Surface Area 259.59 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 2.17 ± eV
Point Group Symmetry C1
Synonyms
  • (5-tert-butyl-1,3,4-oxadiazol-2-yl)-[(2s)-2-pyrrolidinyl]methanone
  • (5-tert-butyl-1,3,4-oxadiazol-2-yl)-[(2s)-pyrrolidin-2-yl]methanone
  • (5-tert-butyl-1,3,4-oxadiazol-2-yl)[(2r)-pyrrolidin-2-yl]methanone
  • 2-prolyl-5-tert-butyl-[1,3,4]oxadiazole
InChIKey YUKGJYBQODPVBL-ZETCQYMHSA-N
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