N-(6-Formyl-4-Oxo-1,4-Dihydro-2-Pteridinyl)Acetamide

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Properties Simple | Detailed

Formula C9H7N5O3+
IUPAC Name n-(6-formyl-4-oxo-1h-pteridin-2-yl)acetamide
Molecular Mass 233.184 g·mol−1
Heat of Formation -124.8 ± 16.7 kJ·mol−1
Dipole Moment 7.03 ± 1.08 D
Volume 247.19 Å 3
Surface Area 242.15 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy 1.33 ± eV
Point Group Symmetry Cs
Synonyms
  • n-(6-formyl-4-hydroxy-2-pteridinyl)acetamide
  • n-(6-formyl-4-keto-1h-pteridin-2-yl)acetamide
  • n-(6-methanoyl-4-oxo-1h-pteridin-2-yl)ethanamide
CAS Number(s)
  • 29769-49-1
InChIKey DDBCPKAHJKOGKK-UHFFFAOYSA-N
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