| Formula |
C27H29FN4O4S |
| IUPAC Name |
2-[4-(4-fluorobenzoyl)-1-piperidyl]-n-[(4-oxo-7,8-dihydro-5h-pyrano[4,3-d]pyrimidin-3-ium-4a-id-2-yl)methyl]-n-(2-thienylmethyl)acetamide |
| Molecular Mass |
524.607 g·mol−1 |
| Heat of Formation |
-586.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.03 ± 1.08 D |
| Volume |
604.64 Å 3 |
| Surface Area |
472.15 Å 2 |
| HOMO Energy |
-9.17 ± 0.55 eV |
| LUMO Energy |
2.24 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
SUKHPNUTRMBUST-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
F
H
O
N
S
|
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