| Formula |
C32H42N6O4S |
| IUPAC Name |
tert-butyl 4-[[2-[4-cyano-n-[(3-methylimidazol-4-yl)methyl]anilino]ethyl-(o-tolylsulfonyl)amino]methyl]piperidine-1-carboxylate |
| Molecular Mass |
606.779 g·mol−1 |
| Heat of Formation |
-459.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
11.46 ± 1.08 D |
| Volume |
739.2 Å 3 |
| Surface Area |
516.55 Å 2 |
| HOMO Energy |
-8.61 ± 0.55 eV |
| LUMO Energy |
-0.89 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
CHEKEDNUVFBGCF-UHFFFAOYSA-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
S
O
N
|
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