({[6-(4-Methylphenyl)Thieno[2,3-D]Pyrimidin-4-Yl]Amino}Methyl)Phosphonic Acid

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Properties Simple | Detailed

Formula C14H14N3O3PS
IUPAC Name [[6-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]amino]methylphosphonic acid
Molecular Mass 335.318 g·mol−1
Heat of Formation -523.2 ± 16.7 kJ·mol−1
Dipole Moment 3.93 ± 1.08 D
Volume 363.77 Å 3
Surface Area 331.89 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy -1.00 ± eV
Point Group Symmetry C1
InChIKey XFTKJMGEXNVSAO-UHFFFAOYSA-N
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