6-Chloro-3-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine 3-Oxide
Properties
Property | Value |
---|---|
Formula | C11H14ClNO |
IUPAC Name | (2r)-2-[2-(2-chloro-6-ethynyl-phenyl)ethynyl]oxaziridin-2-ium |
Molecular Mass | 211.688 g·mol−1 |
Heat of Formation | 1946.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.20 ± 1.08 D |
Volume | 231.68 Å 3 |
Surface Area | 224.32 Å 2 |
HOMO Energy | -9.78 ± 0.55 eV |
LUMO Energy | -3.20 ± eV |
Point Group Symmetry | C1 |
InChIKey | NWKFFNFPWYTDHB-ZDUSSCGKSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C N O Cl |