4-Butyl-4-Hydroxy-1-Phenyl-3,5-Pyrazolidinedione

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Properties Simple | Detailed

Formula C13H16N2O3
IUPAC Name (4r)-4-butyl-4-hydroxy-1-phenyl-pyrazolidine-3,5-dione
Molecular Mass 248.278 g·mol−1
Heat of Formation -340.8 ± 16.7 kJ·mol−1
Dipole Moment 2.43 ± 1.08 D
Volume 300.09 Å 3
Surface Area 274.83 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 2.62 ± eV
Point Group Symmetry C1
InChIKey TUDYIVSCCYEZPE-CYBMUJFWSA-N
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