N-({(2E)-2-[4-(Trifluoromethyl)Benzylidene]Hydrazino}Carbonothioyl)-β-D-Glucopyranosylamine
Properties
Property | Value |
---|---|
Formula | C15H18F3N3O5S |
IUPAC Name | 1-[(e)-[4-(trifluoromethyl)phenyl]methyleneamino]-3-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]thiourea |
Molecular Mass | 409.381 g·mol−1 |
Heat of Formation | -1300.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.19 ± 1.08 D |
Volume | 436.12 Å 3 |
Surface Area | 389.07 Å 2 |
HOMO Energy | -9.03 ± 0.55 eV |
LUMO Energy | 1.33 ± eV |
Point Group Symmetry | C1 |
InChIKey | SPEHXGJLVCNQJH-HORNZCGOSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C F H O N S |