2-(Morpholin-4-Yl)-6-(Thianthren-1-Yl)-4H-Pyran-4-One

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Properties Simple | Detailed

Formula C21H18NO3S2+
IUPAC Name 2-(morpholin-4-yl)-6-(thianthren-1-yl)-4h-pyran-4-one
Molecular Mass 396.503 g·mol−1
Heat of Formation -114.9 ± 16.7 kJ·mol−1
Dipole Moment 7.03 ± 1.08 D
Volume 436.52 Å 3
Surface Area 373.43 Å 2
HOMO Energy -8.37 ± 0.55 eV
LUMO Energy 2.09 ± eV
Point Group Symmetry C1
InChIKey XRKYMMUGXMWDAO-UHFFFAOYSA-O
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