3-({[3-({(E)-[(2,6-Dioxo-1,2,3,6-Tetrahydro-4-Pyrimidinyl)Methylene]Amino}Oxy)Propyl]Amino}Methyl)Benzoic Acid
Properties
Property | Value |
---|---|
Formula | C16H18N4O5 |
IUPAC Name | 3-[[3-[(e)-(2,4-dioxo-1h-pyrimidin-6-yl)methyleneamino]oxypropylamino]methyl]benzoic acid |
Molecular Mass | 346.338 g·mol−1 |
Heat of Formation | -570.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.03 ± 1.08 D |
Volume | 395.62 Å 3 |
Surface Area | 382.45 Å 2 |
HOMO Energy | -9.63 ± 0.55 eV |
LUMO Energy | 1.66 ± eV |
Point Group Symmetry | C1 |
InChIKey | CZTGLADCGFOCLD-VCHYOVAHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |