| Formula |
C21H17Cl2F2N9O3 |
| IUPAC Name |
n-[[5-chloro-2-(2,4-diaza-1-azonia-3-azanidacyclopenta-1,4-dien-1-yl)phenyl]methyl]-2-[6-chloro-3-[[2,2-difluoro-2-(1-oxidopiperidine-2,3,4,5,6-pentaid-2-yl)ethyl]amino]-2-oxo-pyrazin-1-ium-3-ylium-1-yl]acetamide |
| Molecular Mass |
552.321 g·mol−1 |
| Heat of Formation |
-148.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
8.63 ± 1.08 D |
| Volume |
564.6 Å 3 |
| Surface Area |
455.2 Å 2 |
| HOMO Energy |
-8.47 ± 0.55 eV |
| LUMO Energy |
1.47 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-[6-chloro-3-[[2,2-difluoro-2-(1-oxido-2-pyridin-1-iumyl)ethyl]amino]-2-oxo-1-pyrazinyl]-n-[[5-chloro-2-(1-tetrazolyl)phenyl]methyl]acetamide
- 2-[6-chloro-3-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-2-keto-pyrazin-1-yl]-n-[5-chloro-2-(tetrazol-1-yl)benzyl]acetamide
- 2-[6-chloro-3-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-2-oxo-pyrazin-1-yl]-n-[[5-chloro-2-(1,2,3,4-tetrazol-1-yl)phenyl]methyl]ethanamide
- 2-[6-chloro-3-[[2,2-difluoro-2-(1-oxidopyridin-1-ium-2-yl)ethyl]amino]-2-oxo-pyrazin-1-yl]-n-[[5-chloro-2-(tetrazol-1-yl)phenyl]methyl]acetamide
|
| InChIKey |
QOKFRQVFMZFNBC-UHFFFAOYSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
C
Cl
H
F
O
N
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