1,1'-[(2R,3R,3As,7Ar,9R,10R,10As,14Ar)-3,5,10,12-Tetrahydroxy-5,12-Dioxidooctahydro-2H,7H-Difuro[3,2-D:3',2'-J][1,3,7,9,2,8]Tetraoxadiphosphacyclododecine-2,9-Diyl]Di(2,4(1H,3H)-Pyrimidinedione)
Properties
Property | Value |
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Formula | C18H22N4O16P2 |
IUPAC Name | 1-[(1s,3r,6r,8r,9r,10s,12r,15r,17r,18r)-17-(2,4-dioxopyrimidin-1-yl)-3,9,12,18-tetrahydroxy-3,12-dioxo-2,4,7,11,13,16-hexaoxa-3λ5,12λ5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]pyrimidine-2,4-dione |
Molecular Mass | 612.332 g·mol−1 |
Heat of Formation | -3247.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.63 ± 1.08 D |
Volume | 595.99 Å 3 |
Surface Area | 473.23 Å 2 |
HOMO Energy | -9.88 ± 0.55 eV |
LUMO Energy | -1.21 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | ADHSUZMEJHOWOL-NCOIDOBVSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C H O N |