| Formula |
C29H26ClF2N3O3 |
| IUPAC Name |
4-[[(2s)-2-[2-(4-chlorophenyl)-5,6-difluoro-benzimidazol-1-ium-2-ylium-1-yl]-2-cyclohexyl-acetyl]amino]-3-methyl-benzoic acid |
| Molecular Mass |
537.985 g·mol−1 |
| Heat of Formation |
-670.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.75 ± 1.08 D |
| Volume |
607.43 Å 3 |
| Surface Area |
471.15 Å 2 |
| HOMO Energy |
-9.43 ± 0.55 eV |
| LUMO Energy |
1.74 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
XAVJTYOBWCSWFJ-SANMLTNESA-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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