(5-Chloro-2,4-Dihydroxyphenyl)[(2R)-2-(2-Methylphenyl)-1-Pyrrolidinyl]Methanone

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Properties Simple | Detailed

Formula C18H18ClNO3
IUPAC Name (5-chloro-2,4-dihydroxy-phenyl)-[(2r)-2-(o-tolyl)pyrrolidin-1-yl]methanone
Molecular Mass 331.793 g·mol−1
Heat of Formation -457.3 ± 16.7 kJ·mol−1
Dipole Moment 4.32 ± 1.08 D
Volume 379.2 Å 3
Surface Area 329.31 Å 2
HOMO Energy -9.29 ± 0.55 eV
LUMO Energy 2.33 ± eV
Point Group Symmetry C1
InChIKey SOMWPEIBCBZHBS-OAHLLOKOSA-N
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