Official websites use .gov
A
.gov website belongs to an official
government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you've safely
connected to the .gov website. Share sensitive
information only on official, secure websites.
Experimental (in [D6]DMSO) from Ref. 46 (a) and B3LYP/6‐31G(d,p) PCM–DMSO 1H NMR spectra for the 12 selected B‐ring rotated distinct optimized spatial arrangements out of 34 local minima located on the PES for the rutin molecule (c–n). B3LYP spectrum for the fully optimized planar structure 32 is shown for comparison (b). The φ1 and φ2 inter‐ring torsion angles (°) are also given.
