%0 Journal Article
%T Synthesis, Structural Characterization and DFT Studies of Silver(I) Complex Salt of Bis(4,5-dihydro-1<i>H</i>-benzo[g]indazole)
%A Tanyi Rogers Fomuta
%A Golngar Djimassingar
%A Jean Ngoune
%A Nana Odette Ngnabeuye
%A Jean Jacques Anguile
%A Justin Nenwa
%J Crystal Structure Theory and Applications
%P 11-24
%@ 2169-2505
%D 2017
%I Scientific Research Publishing
%R 10.4236/csta.2017.62002
%X A new silver complex salt [Ag(N2C11H10)2]NO3 (where N2C11H10 =
4,5-dihydro-1H-benzo[g]indazole), has been synthesized and characterized by elemental and thermal analyses, IR and 1HNMR spectroscopies, single crystal X-ray structure determination and DFT studies. Its molecular structure comprises of a silver center coordinated to two nitrogen atoms from two 4,5-dihydro-1H-benzo[g]indazole molecule giving rise to a cationic complex entity, [Ag(N2C11H10)2]+ with
as counter ion. The bulk structure is consolidated by N¨CH¡O, C¨CH¡¦Ð, Ag¡¦Ð and Ag¡O intermolecular interactions, thus generating a pseudo-helical network. The optimized structure, frontier molecular orbitals (HOMO and LUMO) and global reactivity descriptors were investigated by performing DFT calculations.
%K Silver Complex Salt
%K 4
%K 5-dihydro-1<
%K i>
%K H<
%K /i>
%K -benzo[g]indazole
%K Hydrogen Bonds
%K Thermogravimetric Analysis
%K <
%K sup>
%K 1<
%K /sup>
%K HNMR
%K X-Ray
%K DFT Studies
%U http://www.scirp.org/journal/PaperInformation.aspx?PaperID=77237