O,O-Diethyl O-(4-Methyl-2-Oxo-4A,8A-Dihydro-2H-Chromen-7-Yl) Phosphorothioate

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Properties Simple | Detailed

Formula C14H19O5PS
IUPAC Name (4ar,8as)-7-diethoxyphosphinothioyloxy-4-methyl-4a,8a-dihydrochromen-2-one
Molecular Mass 330.336 g·mol−1
Heat of Formation -1020.0 ± 16.7 kJ·mol−1
Dipole Moment 5.85 ± 1.08 D
Volume 379.98 Å 3
Surface Area 324.01 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
InChIKey YAEQVHAKRATTCW-CHWSQXEVSA-N
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