Formula |
C22H21ClN2O4S |
IUPAC Name |
4-tert-butyl-n-[4-chloro-2-(1-oxidopyridin-1-ium-4-carbonyl)phenyl]benzenesulfonamide |
Molecular Mass |
444.931 g·mol−1 |
Heat of Formation |
-329.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.25 ± 1.08 D |
Volume |
502.87 Å 3 |
Surface Area |
371.43 Å 2 |
HOMO Energy |
-9.25 ± 0.55 eV |
LUMO Energy |
-1.70 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 4-tert-butyl-n-[4-chloro-2-(1-oxidopyridin-1-ium-4-yl)carbonyl-phenyl]benzenesulfonamide
- 4-tert-butyl-n-[4-chloro-2-[(1-oxido-4-pyridin-1-iumyl)-oxomethyl]phenyl]benzenesulfonamide
|
InChIKey |
JRWROCIMSDXGOZ-UHFFFAOYSA-N |
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Links |
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Downloads |
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Elements |
C
Cl
H
O
N
S
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