(2S)-2-Amino-4-[[(2S,4R,5R)-5-(4-Aminopyrrolo[2,3-D]Pyrimidine-1,3-Diium-4A-Id-7-Yl)-4-Hydroxy-Tetrahydrofuran-2-Yl]Methylsulfanyl]Butanoic Acid
Properties
Property | Value |
---|---|
Formula | C15H21N5O4S |
IUPAC Name | (2s)-2-amino-4-[[(2s,4r,5r)-5-(4-aminopyrrolo[2,3-d]pyrimidine-1,3-diium-4a-id-7-yl)-4-hydroxy-tetrahydrofuran-2-yl]methylsulfanyl]butanoic acid |
Molecular Mass | 367.423 g·mol−1 |
Heat of Formation | -523.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.45 ± 1.08 D |
Volume | 420.25 Å 3 |
Surface Area | 367.68 Å 2 |
HOMO Energy | -8.64 ± 0.55 eV |
LUMO Energy | -0.23 ± eV |
Point Group Symmetry | C1 |
InChIKey | HINMILXKBCXOMF-HJUHTLPRSA-O |
QR Code | Generate QR Code |
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Elements | H S C O N |