3-(7-Amino-4,5-Dioxo-1,4,5,6-Tetrahydropyrimido[4,5-C]Pyridazin-3-Yl)Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C9H9N5O4 |
IUPAC Name | 3-(7-amino-4,5-dioxo-1,8-dihydropyrimido[4,5-c]pyridazin-3-yl)propanoic acid |
Molecular Mass | 251.199 g·mol−1 |
Heat of Formation | -413.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 10.32 ± 1.08 D |
Volume | 262.26 Å 3 |
Surface Area | 250.47 Å 2 |
HOMO Energy | -9.86 ± 0.55 eV |
LUMO Energy | 1.94 ± eV |
Point Group Symmetry | C1 |
InChIKey | CGUTUVAIFLDCOT-UHFFFAOYSA-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 |