Formula |
C16H15ClN4O2 |
IUPAC Name |
(1e)-2-(5-tert-butylisoxazol-3-yl)-n-(3-chloroanilino)-2-oxo-acetimidoyl cyanide |
Molecular Mass |
330.769 g·mol−1 |
Heat of Formation |
237.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.52 ± 1.08 D |
Volume |
388.03 Å 3 |
Surface Area |
355.72 Å 2 |
HOMO Energy |
-9.38 ± 0.55 eV |
LUMO Energy |
1.67 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (2e)-3-(5-tert-butyl-1,2-oxazol-3-yl)-2-[(3-chlorophenyl)hydrazinylidene]-3-oxo-propanenitrile
- (2e)-3-(5-tert-butyl-3-isoxazolyl)-2-[(3-chlorophenyl)hydrazono]-3-oxopropanenitrile
- (2e)-3-(5-tert-butylisoxazol-3-yl)-2-[(3-chlorophenyl)hydrazono]-3-keto-propionitrile
- 2-(5-tert-butyl-1,2-oxazol-3-yl)-n-[(3-chlorophenyl)amino]-2-oxoethanimidoyl cyanide
- 2-(5-tert-butylisoxazol-3-yl)-n-[(3-chlorophenyl)amino]-2-oxo-acetimidoyl cyanide
- 3-(5-tert-butyl-1,2-oxazol-3-yl)-2-[(3-chlorophenyl)hydrazinylidene]-3-oxo-propanenitrile
- 3-(5-tert-butyl-3-isoxazolyl)-2-[(3-chlorophenyl)hydrazono]-3-oxopropanenitrile
- 3-(5-tert-butylisoxazol-3-yl)-2-[(3-chlorophenyl)hydrazono]-3-keto-propionitrile
- sr-01000639519-1
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InChIKey |
DXEATJQGQHDURZ-DEDYPNTBSA-N |
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Links |
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Elements |
H
C
N
O
Cl
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