Metal-Organic Frameworks (MOFs) as Safer, Structurally Reinforced Energetics

被引:136
作者
Bushuyev, Oleksandr S. [1 ]
Peterson, Geneva R. [1 ]
Brown, Preston [1 ]
Maiti, Amitesh [2 ]
Gee, Richard H. [2 ]
Weeks, Brandon L. [3 ]
Hope-Weeks, Louisa J. [1 ]
机构
[1] Texas Tech Univ, Dept Chem & Biochem, Lubbock, TX 79409 USA
[2] Lawrence Livermore Natl Lab, Livermore, CA 94550 USA
[3] Texas Tech Univ, Dept Chem Engn, Lubbock, TX 79409 USA
关键词
coordination polymers; crystal engineering; density functional calculations; energetic materials; metal-organic frameworks; NICKEL HYDRAZINE NITRATE; MOLECULAR-STRUCTURE; CRYSTAL-STRUCTURE; EXPLOSIVES; PERCHLORATE; AZIDE; NHN;
D O I
10.1002/chem.201203610
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Second-generation cobalt and zinc coordination architectures were obtained through efforts to stabilize extremely sensitive and energetic transition-metal hydrazine perchlorate ionic polymers. Partial ligand substitution by the tridentate hydrazinecarboxylate anion afforded polymeric 2D-sheet structures never before observed for energetic materials. Carefully balanced reaction conditions allowed the retention of the noncoordinating perchlorate anion in the presence of a strongly chelating hydrazinecarboxylate ligand. High-quality X-ray single-crystal structure determination revealed that the metal coordination preferences lead to different structural motifs and energetic properties, despite the nearly isoformulaic nature of the two compounds. Energetic tests indicate highly decreased sensitivity and DFT calculations suggest a high explosive performance for these remarkable structures.
引用
收藏
页码:1706 / 1711
页数:6
相关论文
共 27 条
[1]   STRUCTURES OF CHELATES OF HYDRAZINECARBOXYLIC ACID - BIS(HYDRAZINECARBOXYLATO-N',O)-ZINC [J].
BIGOLI, F ;
BRAIBANT.A ;
TIRIPICC.A ;
CAMELLIN.MT .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1971, B 27 (DEC15) :2453-&
[2]   CRYSTAL AND MOLECULAR STRUCTURE OF BIS(HYDRAZINECARBOXYLATO-N',O)-NICKEL DIHYDRATE AND COMPARISONS WITH OTHER COMPLEXES OF LIGAND [J].
BRAIBANT.A ;
LANFREDI, AM ;
TIRIPICC.A ;
BIGOLI, F .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1970, B 26 :806-&
[3]   CRYSTAL AND MOLECULAR STRUCTURE OF HYDRAZINIUM TRIS(HYDRAZINCARBOXYLATO-N'O)NICCOLATE(2) MONOHYDRATE [J].
BRAIBANTI, A ;
LANFREDI, AM ;
TIRIPICCHIO, A .
ZEITSCHRIFT FUR KRISTALLOGRAPHIE KRISTALLGEOMETRIE KRISTALLPHYSIK KRISTALLCHEMIE, 1967, 124 (4-5) :335-+
[4]   CRYSTAL AND MOLECULAR STRUCTURE OF BIS(HYDRAZINECARBOXYLATO-N'O)MANGANESE(2) DIHYDRATE [J].
BRAIBANTI, A ;
TIRIPICCHIO, A ;
LANFREDI, AM ;
CAMELLINI, M .
ACTA CRYSTALLOGRAPHICA, 1967, 23 :248-+
[5]   CRYSTAL STRUCTURE OF BIS(HYDRAZINCARBOXYLATO-N',O) CADMIUM [J].
BRAIBANTI, A ;
TIRIPICCHIO, A ;
LANFREDI, AM ;
BIGOLI, F .
ZEITSCHRIFT FUR KRISTALLOGRAPHIE KRISTALLGEOMETRIE KRISTALLPHYSIK KRISTALLCHEMIE, 1968, 126 (04) :307-+
[6]   Ionic Polymers as a New Structural Motif for High-Energy-Density Materials [J].
Bushuyev, Oleksandr S. ;
Brown, Preston ;
Maiti, Amitesh ;
Gee, Richard H. ;
Peterson, Geneva R. ;
Weeks, Brandon L. ;
Hope-Weeks, Louisa J. .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2012, 134 (03) :1422-1425
[7]   REACTION OF 1,1'-DIACETYLFERROCENE WITH HYDRAZINE HYDRATE - SYNTHESIS AND X-RAY CRYSTAL-STRUCTURES OF BIS(HYDRAZINE)BIS(HYDRAZINECARBOXYLATO-N',O)IRON(II), [FE(N2H4)2(O2CNHNH2)2], AND THE CYCLIC BIFERROCENE DIAZINE, [-N(ME)CC5H4FEC5H4C(ME)N-]2 [J].
CASEY, MT ;
GUINAN, P ;
CANAVAN, A ;
MCCANN, M ;
CARDIN, C ;
KELLY, NB .
POLYHEDRON, 1991, 10 (4-5) :483-489
[8]   Synthesis, characterization and thermal studies of (Ni/Co) metal salts of hydrazine: potential initiatory compounds [J].
Chhabra, JS ;
Talawar, MB ;
Makashir, PS ;
Asthana, SN ;
Singh, H .
JOURNAL OF HAZARDOUS MATERIALS, 2003, 99 (03) :225-239
[9]   NEW GROUP-2 METAL HYDRAZINECARBOXYLATES - A NOVEL COORDINATION MODE FOR HYDRAZINECARBOXYLATE IN A POLYMERIC, 10-CO-ORDINATE BARIUM COMPLEX [J].
EDWARDS, DA ;
KEILY, JF ;
MAHON, MF ;
MOLLOY, KC ;
THOMPSETT, D .
JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS, 1993, (23) :3471-3474
[10]   CRYSTAL AND MOLECULAR STRUCTURE OF BIS(HYDRAZINE)ZINC BIS (HYDRAZINCARBOXYLATE-N' O) [J].
FERRARI, A ;
BRAIBANT.A ;
BIGLIARD.G ;
LANFREDI, AM .
ZEITSCHRIFT FUR KRISTALLOGRAPHIE, 1965, 122 (3-4) :259-&