Independent Control of Optical and Explosive Properties: Pyrazole-Tetrazine Complexes of First Row Transition Metals

被引:21
作者
Myers, Thomas W. [1 ]
Chavez, David E. [1 ]
Hanson, Susan K. [2 ]
Scharff, R. Jason [1 ]
Scott, Brian L. [3 ]
Veauthier, Jacqueline M. [2 ]
Wu, Ruilian [4 ]
机构
[1] Los Alamos Natl Lab, M Div, Los Alamos, NM 87545 USA
[2] Los Alamos Natl Lab, Div Chem, Los Alamos, NM 87545 USA
[3] Los Alamos Natl Lab, Mat Phys & Applicat, Los Alamos, NM 87545 USA
[4] Los Alamos Natl Lab, Biosci Div, Los Alamos, NM 87545 USA
关键词
NITROGEN-RICH; LIGAND; COPPER; DECOMPOSITION; PERCHLORATE; COMBUSTION; ABSORPTION; INITIATION; CHEMISTRY; NITRATE;
D O I
10.1021/acs.inorgchem.5b01313
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
Complexes of 3-amino-6-(3,5-dimethylpyrazole)-tetrazine) (NH(2)TzDMP, 1) and 3-(3,3'-dinitroazetidine)-6-(3,5-dimethylpyrazole)tetrazine) (DNAZTzDMP, 2) with first row transition metal centers were synthesized. Reactions of Fe-II(H2O)(6)(BF4)(2) and Fe(NO3)(3)center dot 9H(2)O with 1 and 2 both led to complexes of the form [(RTzDMP)(3)Fe]X-2 (X = BF4, R = NH2 (3), DNAZ (4); X = NO3, R = NH2 (5), DNAZ (6)), which showed intense MLCT bands in the visible region of the spectrum. Ligands 1 and 2 also reacted with Cu-II(NO3)(2)center dot 5/2H(2)O to form [(RTzDMP)(2)Cu(NO3)][NO3] (R = NH2 (7), DNAZ (8)) in addition to reacting with Cu-I(CH3CN)(4)(PF6) to form [(RTzDMP)(2)Cu][PF6] (R = NH2 (9), DNAZ (10)). Lastly reactions of 1 and 2 with Co(NO3)(2)center dot 6H(2)O and Ni(NO3)(2)center dot 6H(2)O led to [(NH(2)TzDMP)(2)Co(H2O) (NO3)] [NO3] (11), [(DNAZTzDMP)(2)Co(H2O)(2)] [NO3](2) (12), [(NH(2)TzDMP)(3)Ni][NO3](2) (13), and [(DNAZTzDMP)(2)Ni(H2O)(2)[NO3](2) (14). The complexes display rich electrochemical and photophysical properties that are unaffected by derivation with explosive groups.
引用
收藏
页码:8077 / 8086
页数:10
相关论文
共 56 条
  • [1] Understanding Limits of the Thermal Mechanism of Laser Initiation of Energetic Materials
    Aluker, Edward D.
    Krechetov, Alexander G.
    Mitrofanov, Anatoliy Y.
    Zverev, Anton S.
    Kuklja, Maija M.
    [J]. JOURNAL OF PHYSICAL CHEMISTRY C, 2012, 116 (46) : 24482 - 24486
  • [2] [Anonymous], 1999, SAINT SOFTW US GUID
  • [3] [Anonymous], SMART SOFTW US GUID
  • [4] Multiplying the electron storage capacity of a bis-tetrazine pincer ligand
    Benson, Christopher R.
    Hui, Alice K.
    Parimal, Kumar
    Cook, Brian J.
    Chen, Chun-Hsing
    Lord, Richard L.
    Flood, Amar H.
    Caulton, Kenneth G.
    [J]. DALTON TRANSACTIONS, 2014, 43 (17) : 6513 - 6524
  • [5] Nonadiabatic Decomposition of Gas-Phase RDX through Conical Intersections: An ONIOM-CASSCF Study
    Bhattacharya, A.
    Bernstein, E. R.
    [J]. JOURNAL OF PHYSICAL CHEMISTRY A, 2011, 115 (17) : 4135 - 4147
  • [6] Bowden M. D., 2007, P SOC PHOTO-OPT INS, V6662, P08
  • [7] Chavez D.E., 1999, J. Energ. Mater, V17, P357, DOI [DOI 10.1080/07370659908201796, 10.1080/07370659908201796]
  • [8] Electroactive Explosives: Nitrate Ester-Functionalized 1,2,4,5-Tetrazines
    Chavez, David E.
    Hanson, Susan K.
    Veauthier, Jacqueline M.
    Parrish, Damon A.
    [J]. ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2013, 52 (27) : 6876 - 6879
  • [9] Synthesis of 3,6-bis(3-azido-1,2,4-triazol-1-yl)-1,2,4,5-tetrazine
    Chavez, David E.
    Gilardi, Richard D.
    [J]. JOURNAL OF ENERGETIC MATERIALS, 2009, 27 (02) : 110 - 117
  • [10] Synthesis of the bi-heterocyclic parent ring system 1,2,4-triazolo[4,3-b][1,2,4,5]tetrazine and some 3,6-disubstituted derivatives
    Chavez, DE
    Hiskey, MA
    [J]. JOURNAL OF HETEROCYCLIC CHEMISTRY, 1998, 35 (06) : 1329 - 1332