(5S)-5-(2,3-Dihydro-1-Benzofuran-7-Yl)-3-Methyl-8-Nitro-2,3,4,5-Tetrahydro-1H-3-Benzazepin-7-Ol
Properties
Property | Value |
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Formula | C19H20N2O4 |
IUPAC Name | (3s,5s)-5-(2,3-dihydrobenzofuran-7-yl)-3-methyl-8-nitro-1,2,4,5-tetrahydro-3-benzazepin-7-ol |
Molecular Mass | 340.373 g·mol−1 |
Heat of Formation | -205.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.36 ± 1.08 D |
Volume | 391.63 Å 3 |
Surface Area | 334.71 Å 2 |
HOMO Energy | -8.85 ± 0.55 eV |
LUMO Energy | 1.85 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | XZPSYCOYKJRHKE-MRXNPFEDSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |