5H-Pyrrolo[2,3-D]Pyrimidine

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Properties Simple | Detailed

Formula C6H5N3
IUPAC Name 5h-pyrrolo[2,3-d]pyrimidine
Molecular Mass 119.124 g·mol−1
Heat of Formation 318.0 ± 16.7 kJ·mol−1
Dipole Moment 5.04 ± 1.08 D
Volume 137.6 Å 3
Surface Area 144.57 Å 2
HOMO Energy -10.38 ± 0.55 eV
LUMO Energy 1.77 ± eV
Point Group Symmetry Cs
Synonyms
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InChIKey NUTIPMCDNFPBQT-UHFFFAOYSA-N
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Elements H C N