Formula |
C7H5N3O |
IUPAC Name |
pyrido[4,3-d]pyrimidin-1-ium-3-id-4-one |
Molecular Mass |
147.134 g·mol−1 |
Heat of Formation |
74.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
7.43 ± 1.08 D |
Volume |
161.28 Å 3 |
Surface Area |
162.93 Å 2 |
HOMO Energy |
-9.99 ± 0.55 eV |
LUMO Energy |
1.88 ± eV |
Point Group Symmetry |
Cs
|
Synonyms
|
- pyrido[4,3-d]pyrimidin-4(3h)-one
- pyrido[4,3-d]pyrimidin-4-ol
|
InChIKey |
RADMRAMXLLLVGG-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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|
Elements |
H
C
O
N
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