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-[(2,6-dioxopyrimidin-4-yl)methylamino]propoxyiminomethyl]benzoic acid
Molecular Mass 346.338 g·mol−1
Heat of Formation -568.0 ± 16.7 kJ·mol−1
Dipole Moment 6.73 ± 1.08 D
Volume 397.43 Å 3
Surface Area 383.45 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy 2.02 ± eV
Point Group Symmetry C1
InChIKey DNNMFLCWPRQYIC-GIJQJNRQSA-P
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