| Formula |
C22H27FN4O2 |
| IUPAC Name |
(1r,2r)-n-(1-cyanocyclopropyl)-2-[4-(4-fluorophenyl)piperazine-1-carbonyl]cyclohexanecarboxamide |
| Molecular Mass |
398.474 g·mol−1 |
| Heat of Formation |
-304.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.05 ± 1.08 D |
| Volume |
479.14 Å 3 |
| Surface Area |
383.94 Å 2 |
| HOMO Energy |
-9.07 ± 0.55 eV |
| LUMO Energy |
-0.27 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
GHDIYQHGVKVLJX-RTBURBONSA-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
F
O
N
|
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