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

Molecule SVG Image

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 -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
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N