(2R,3R,3As,6E,9Ar)-2-(Hydroxymethyl)-6-Imino-2,3,3A,9A-Tetrahydro-6H-Furo[2',3':4,5][1,3]Oxazolo[3,2-A]Pyrimidin-3-Ol
Properties
Property | Value |
---|---|
Formula | C9H11N3O4 |
IUPAC Name | (2r,4r,5r,6s)-4-(hydroxymethyl)-10-imino-3,7-dioxa-1,9-diazatricyclo[6.4.0.02,6]dodeca-8,11-dien-5-ol |
Molecular Mass | 225.201 g·mol−1 |
Heat of Formation | 588.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.92 ± 1.08 D |
Volume | 212.42 Å 3 |
Surface Area | 211.86 Å 2 |
HOMO Energy | -9.45 ± 0.55 eV |
LUMO Energy | -2.23 ± eV |
Point Group Symmetry | Cs |
InChIKey | BBDAGFIXKZCXAH-PJNBIRNISA-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 |