| Formula |
C16H14N4S |
| IUPAC Name |
4-(2,4-dimethylphenyl)-2-methylsulfanyl-7h-pyrrolo[2,3-d]pyrimidine-5-carbonitrile |
| Molecular Mass |
294.374 g·mol−1 |
| Heat of Formation |
390.1 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.61 ± 1.08 D |
| Volume |
348.83 Å 3 |
| Surface Area |
307.25 Å 2 |
| HOMO Energy |
-8.58 ± 0.55 eV |
| LUMO Energy |
1.96 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 4-(2,4-dimethylphenyl)-2-(methylthio)-7h-pyrrolo[5,4-d]pyrimidine-5-carbonitrile
|
| InChIKey |
LXUVFEGNZXPXCA-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
C
S
N
|
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