| Formula |
C22H16FN3O6S2 |
| IUPAC Name |
4-[1-[4-(fluoromethylsulfonyl)-1,1-dioxo-2h-thiazolo[4,5-c]pyridine-3-carbonyl]-1-azaspiro[2.6]nona-4,6,8-trien-2-ylidene]cyclohexa-2,5-dien-1-one |
| Molecular Mass |
501.507 g·mol−1 |
| Heat of Formation |
2611.3 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.82 ± 1.08 D |
| Volume |
490.78 Å 3 |
| Surface Area |
392.29 Å 2 |
| HOMO Energy |
-10.14 ± 0.55 eV |
| LUMO Energy |
-2.47 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1-cycloheptyl-1-[[4-(4-fluorophenoxy)phenyl]methyl]-3-[6-methyl-2,4-bis(methylsulfonyl)pyridin-3-yl]urea
- 1-cycloheptyl-3-(2,4-dimesyl-6-methyl-3-pyridyl)-1-[4-(4-fluorophenoxy)benzyl]urea
- fr-190809
|
| InChIKey |
UFRBZRWETFGORO-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
S
N
C
O
F
|
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