(4S)-N-(4-Amino-5-Chloro-2-Methoxy-Benzoyl)-2,3,4,5-Tetrahydropyridin-4-Amine Oxide
Properties
Property | Value |
---|---|
Formula | C13H18ClN3O3 |
IUPAC Name | (4-amino-5-chloro-2-methoxy-phenyl)-[hydroxy-[(4s)-2,3,4,5-tetrahydropyridin-4-yl]-λ5-azanyl]methanone |
Molecular Mass | 299.753 g·mol−1 |
Heat of Formation | -179.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.08 ± 1.08 D |
Volume | 333.75 Å 3 |
Surface Area | 282.71 Å 2 |
HOMO Energy | -8.75 ± 0.55 eV |
LUMO Energy | 1.95 ± eV |
Point Group Symmetry | C1 |
InChIKey | DLWDUSJZENPMKA-MRVPVSSYSA-N |
QR Code | Generate QR Code |
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Elements | H C N O Cl |