| Formula |
C28H30ClN7O2 |
| IUPAC Name |
3-[4-[(2z)-2-[4-[[(2s)-2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]-2-oxo-3-pyridylidene]-7-methyl-1,3-dihydrobenzimidazol-5-yl]piperazin-1-yl]propanenitrile |
| Molecular Mass |
532.036 g·mol−1 |
| Heat of Formation |
121.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.31 ± 1.08 D |
| Volume |
624.74 Å 3 |
| Surface Area |
537.4 Å 2 |
| HOMO Energy |
-8.32 ± 0.55 eV |
| LUMO Energy |
-1.27 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
ATYVNAJZCAQFEZ-GJSRYIRCSA-N |
| QR Code |
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| Links |
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| DOI |
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| Downloads |
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|
| Elements |
H
C
N
O
Cl
|
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