(2R,3S,4R,5S)-N-Butyl-3,4,5-Trihydroxy-2-(Hydroxymethyl)-1-Piperidinecarbothioamide
Properties
Property | Value |
---|---|
Formula | C11H22N2O4S |
IUPAC Name | (2r,3s,4r,5s)-n-butyl-3,4,5-trihydroxy-2-(hydroxymethyl)piperidine-1-carbothioamide |
Molecular Mass | 278.368 g·mol−1 |
Heat of Formation | -751.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.30 ± 1.08 D |
Volume | 340.01 Å 3 |
Surface Area | 294.69 Å 2 |
HOMO Energy | -8.68 ± 0.55 eV |
LUMO Energy | 2.40 ± eV |
Point Group Symmetry | C1 |
InChIKey | VCRXDLDGTLMSHK-XFWSIPNHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |