5-Ethynyl-1-[(1R,4R)-3-Hydroxy-4-(Hydroxymethyl)Cyclopentyl]-2,4(1H,3H)-Pyrimidinedione
Properties
Property | Value |
---|---|
Formula | C12H14N2O4 |
IUPAC Name | 5-ethynyl-1-[(1s,3r,4r)-3-hydroxy-4-(hydroxymethyl)cyclopentyl]pyrimidine-2,4-dione |
Molecular Mass | 250.251 g·mol−1 |
Heat of Formation | -475.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.74 ± 1.08 D |
Volume | 289.86 Å 3 |
Surface Area | 267.32 Å 2 |
HOMO Energy | -9.43 ± 0.55 eV |
LUMO Energy | 2.10 ± eV |
Point Group Symmetry | C1 |
InChIKey | OFNUFFYMOSNFTB-KXUCPTDWSA-P |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
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Elements | H C O N |