| Formula |
C22H22N6O2 |
| IUPAC Name |
2-[1-[6-[6-(cyclopentylamino)-7h-indazol-1-ium-7-id-1-yl]pyrazin-2-yl]-2h-pyrrol-1-ium-2-ylium-3-yl]acetic acid |
| Molecular Mass |
402.449 g·mol−1 |
| Heat of Formation |
174.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.82 ± 1.08 D |
| Volume |
473.21 Å 3 |
| Surface Area |
419.52 Å 2 |
| HOMO Energy |
-8.41 ± 0.55 eV |
| LUMO Energy |
-1.12 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[1-[6-[6-(cyclopentylamino)-1-indazolyl]-2-pyrazinyl]-3-pyrrolyl]acetic acid
- 2-[1-[6-[6-(cyclopentylamino)indazol-1-yl]pyrazin-2-yl]pyrrol-3-yl]acetic acid
- 2-[1-[6-[6-(cyclopentylamino)indazol-1-yl]pyrazin-2-yl]pyrrol-3-yl]ethanoic acid
|
| InChIKey |
YQTMYRNBXJDYDN-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
N
|
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