Spiradoline

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Properties Simple | Detailed

Formula C22H30Cl2N2O2
IUPAC Name 2-(3,4-dichlorophenyl)-n-methyl-n-[(5r,7s,8s)-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-8-yl]acetamide
Molecular Mass 425.392 g·mol−1
Heat of Formation -437.7 ± 16.7 kJ·mol−1
Dipole Moment 7.16 ± 1.08 D
Volume 508.6 Å 3
Surface Area 403.88 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(3,4-dichlorophenyl)-n-methyl-n-[(5r,7s,8s)-7-1-pyrrolidinyl-1-oxaspiro[4.5]decan-8-yl]acetamide
  • 2-(3,4-dichlorophenyl)-n-methyl-n-[(5r,7s,8s)-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-8-yl]acetamide
  • 2-(3,4-dichlorophenyl)-n-methyl-n-[(5r,7s,8s)-7-pyrrolidin-1-yl-1-oxaspiro[4.5]decan-8-yl]ethanamide
  • benzeneacetamide, 3,4-dichloro-n-methyl-n-(7-(1-pyrrolidinyl)-1-oxaspiro(4,5)dec-8-yl)-, (5alpha,7alpha,8beta)-(+-)-
  • espiradolina [spanish]
  • pdsp2_001723
  • spiradolinum [latin]
  • u 62066
CAS Number(s)
  • 87151-85-7
InChIKey NYKCGQQJNVPOLU-ONTIZHBOSA-N
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Elements H C N O Cl