| Formula |
C18H15BrN5+ |
| IUPAC Name |
3-bromo-5-phenyl-n-(4-pyridylmethyl)-1h-pyrazolo[1,5-a]pyrimidin-8-ium-7-amine |
| Molecular Mass |
381.249 g·mol−1 |
| Heat of Formation |
618.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.03 ± 1.08 D |
| Volume |
387.62 Å 3 |
| Surface Area |
356.52 Å 2 |
| HOMO Energy |
-8.46 ± 0.55 eV |
| LUMO Energy |
1.05 ± eV |
| Point Group Symmetry |
Cs
|
| Synonyms
|
- (3-bromo-5-phenyl-1h-pyrazolo[5,1-b]pyrimidin-8-ium-7-yl)-(4-pyridylmethyl)amine
- 3-bromo-5-phenyl-n-(4-pyridylmethyl)-1h-pyrazolo[5,1-b]pyrimidin-8-ium-7-amine
- 3-bromo-5-phenyl-n-(pyridin-4-ylmethyl)-1h-pyrazolo[5,1-b]pyrimidin-8-ium-7-amine
|
| InChIKey |
ACPFGNKNDMTMDR-UHFFFAOYSA-O |
| QR Code |
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| Links |
PubChem
|
| DOI |
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| Downloads |
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|
| Elements |
H
C
Br
N
|
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