Formula |
C16H12F2N2O3S |
IUPAC Name |
4-[5-(difluoromethyl)-3-phenyl-isoxazol-4-yl]benzenesulfonamide |
Molecular Mass |
350.340 g·mol−1 |
Heat of Formation |
-444.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.12 ± 1.08 D |
Volume |
372.74 Å 3 |
Surface Area |
318.39 Å 2 |
HOMO Energy |
-10.00 ± 0.55 eV |
LUMO Energy |
-1.07 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 4-[(5-difluoromethyl-3-phenyl)-4-isoxazolyl]benzenesulfonamide
- 4-[5-(difluoromethyl)-3-phenyl-4-isoxazolyl]benzenesulfonamide
- cox-2 inhibitor ii
- sc-791
|
InChIKey |
DVSOGWILWKEIDD-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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