3-{(E)-[(3-{[(2,6-Dioxo-1,2,3,6-Tetrahydro-4-Pyrimidinyl)Methyl]Amino}Propoxy)Imino]Methyl}Benzoic Acid

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Properties Simple | Detailed

Formula C16H18N4O5++
IUPAC Name 3-[(e)-3-[(2,4-dioxo-1h-pyrimidin-6-yl)methylamino]propoxyiminomethyl]benzoic acid
Molecular Mass 346.338 g·mol−1
Heat of Formation -566.8 ± 16.7 kJ·mol−1
Dipole Moment 6.47 ± 1.08 D
Volume 397.91 Å 3
Surface Area 383.13 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy -0.99 ± eV
Point Group Symmetry C1
InChIKey DNNMFLCWPRQYIC-GIJQJNRQSA-N
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