1,3-Dimethyl-2,4,7-Trioxo-1,2,3,4,7,8-Hexahydro-6-Pteridinecarbaldehyde

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Properties Simple | Detailed

Formula C9H8N4O4
IUPAC Name 1,3-dimethyl-2,4,7-trioxo-8h-pteridine-6-carbaldehyde
Molecular Mass 236.184 g·mol−1
Heat of Formation -458.2 ± 16.7 kJ·mol−1
Dipole Moment 7.54 ± 1.08 D
Volume 245.33 Å 3
Surface Area 233.38 Å 2
HOMO Energy -9.82 ± 0.55 eV
LUMO Energy 1.42 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,3-dimethyl-2,4,7-trioxo-8h-pteridine-6-carboxaldehyde
  • 2,4,7-triketo-1,3-dimethyl-8h-pteridine-6-carbaldehyde
  • ab-323/13887262
  • oprea1_527984
InChIKey LVJCGSZYPTZSMO-UHFFFAOYSA-N
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