(4S,5R)-5-Hydroxy-4-(3-Hydroxyphenyl)-3,4,5,6,7,8-Hexahydro-2(1H)-Quinazolinethione

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Formula C14H16N2O2S
IUPAC Name (4s,5r)-5-hydroxy-4-(3-hydroxyphenyl)-3,4,5,6,7,8-hexahydro-1h-quinazoline-2-thione
Molecular Mass 276.354 g·mol−1
Heat of Formation -219.5 ± 16.7 kJ·mol−1
Dipole Moment 6.12 ± 1.08 D
Volume 321.69 Å 3
Surface Area 281.51 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy -0.54 ± eV
Point Group Symmetry C1
InChIKey RZXURKNWIBRDDX-YPMHNXCESA-N
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