N-{[(2E)-2-(4-Bromobenzylidene)Hydrazino]Carbonothioyl}-β-D-Glucopyranosylamine
Properties
Property | Value |
---|---|
Formula | C14H18BrN3O5S |
IUPAC Name | 1-[(e)-(4-bromophenyl)methyleneamino]-3-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]thiourea |
Molecular Mass | 420.279 g·mol−1 |
Heat of Formation | -617.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.58 ± 1.08 D |
Volume | 425.43 Å 3 |
Surface Area | 378.05 Å 2 |
HOMO Energy | -8.91 ± 0.55 eV |
LUMO Energy | -1.72 ± eV |
Point Group Symmetry | C1 |
InChIKey | BNLZUNIPJMEPID-QCOQDYPWSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C H O N S Br |