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Synthesis and characterization of thermally stable energetic complexes with 3,5-diaminopyrazolone-4-oxime as a nitrogen-rich ligand
Energetic metal organic frameworks (EMOFs) are increasingly developed and have proven to be candidates for novel high energy density materials (HEDM). Here, two energetic metal complexes based on 3,5-diaminopyrazolone-4-oxime (DAPO) ligands were synthesized by simple steps and fully characterized by...
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| Published in: | CrystEngComm 2022-08, Vol.24 (3), p.5519-5526 |
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| creator | Zhang, Lu Dong, Wen-Shuai Lu, Zu-Jia Wang, Ting-Wei Zhang, Chao Zhou, Zun-Ning Zhang, Jian-Guo |
| description | Energetic metal organic frameworks (EMOFs) are increasingly developed and have proven to be candidates for novel high energy density materials (HEDM). Here, two energetic metal complexes based on 3,5-diaminopyrazolone-4-oxime (DAPO) ligands were synthesized by simple steps and fully characterized by NMR and IR spectroscopy, X-ray single-crystal diffraction, and DSC-TG. The detonation performance was calculated using the Kamlet-Jacobs formula. The crystal densities of these complexes (C
6
H
14
N
12
O
10
Co (
2
) and C
6
H
14
N
12
O
10
Cd (
3
) are as high as 1.945 g cm
3
at 163 K and 2.072 g cm
−3
at 298 K, respectively. Thermal analysis by the DSC-TG test shows that they all have good thermal stability with the highest decomposition temperatures of 287 °C and 344 °C, respectively. These two as-synthesized complexes exhibit excellent detonation performance;
2
(
D
= 8682 m s
−1
,
P
= 34.98 GPa) and
3
(
D
= 8383 m s
−1
,
P
= 33.78 GPa) have good detonation velocity and detonation pressure that are superior to those of TNT, which is widely used today. Thus, they show great promise for potential applications as thermally stable energetic materials.
Two thermally stable complexes based on DAPO were synthesized. The thermal decomposition temperatures were 287 °C and 344 °C, respectively. The detonation properties of the complexes were excellent with good detonation velocity and detonation pressure superior to that of TNT. |
| doi_str_mv | 10.1039/d2ce00715k |
| format | article |
| fullrecord | <record><control><sourceid>proquest_cross</sourceid><recordid>TN_cdi_proquest_journals_2697017454</recordid><sourceformat>XML</sourceformat><sourcesystem>PC</sourcesystem><sourcerecordid>2697017454</sourcerecordid><originalsourceid>FETCH-LOGICAL-c281t-d4a9654916a0acb9a878d17cac0a88540ab738e57c104e0d8cf47acd7e2c10593</originalsourceid><addsrcrecordid>eNpNkU1PwzAMhisEEmNw4Y4UiRuikLRp0x7RGB9iEgfgXHmpu2a0SUkyse7KH6cwBJxs2Y_8SK-D4JjRC0bj_LKMJFIqWPK6E4wYT9Mwo3G8-6_fDw6cW1LKOGN0FHw89drX6JQjoEsia7AgPVq1Aa-MJqYiw9q20DQ9cR7mDRLUaBfolSTStF2Da3TkXfmaxOdJWCpolTZdb2FjGqMx5KFZqxYJDAqilbdmgTq0StakUYvBehjsVdA4PPqp4-DlZvo8uQtnj7f3k6tZKKOM-bDkkKcJz1kKFOQ8h0xkJRMSJIUsSziFuYgzTIRklCMtM1lxAbIUGA2TJI_Hwen2bmfN2wqdL5ZmZfWgLKI0F5QJnvCBOttS0hrnLFZFZ1ULti8YLb5CLq6jyfQ75IcBPtnC1slf7u8J8SfRF3sy</addsrcrecordid><sourcetype>Aggregation Database</sourcetype><iscdi>true</iscdi><recordtype>article</recordtype><pqid>2697017454</pqid></control><display><type>article</type><title>Synthesis and characterization of thermally stable energetic complexes with 3,5-diaminopyrazolone-4-oxime as a nitrogen-rich ligand</title><source>Royal Society of Chemistry</source><creator>Zhang, Lu ; Dong, Wen-Shuai ; Lu, Zu-Jia ; Wang, Ting-Wei ; Zhang, Chao ; Zhou, Zun-Ning ; Zhang, Jian-Guo</creator><creatorcontrib>Zhang, Lu ; Dong, Wen-Shuai ; Lu, Zu-Jia ; Wang, Ting-Wei ; Zhang, Chao ; Zhou, Zun-Ning ; Zhang, Jian-Guo</creatorcontrib><description>Energetic metal organic frameworks (EMOFs) are increasingly developed and have proven to be candidates for novel high energy density materials (HEDM). Here, two energetic metal complexes based on 3,5-diaminopyrazolone-4-oxime (DAPO) ligands were synthesized by simple steps and fully characterized by NMR and IR spectroscopy, X-ray single-crystal diffraction, and DSC-TG. The detonation performance was calculated using the Kamlet-Jacobs formula. The crystal densities of these complexes (C
6
H
14
N
12
O
10
Co (
2
) and C
6
H
14
N
12
O
10
Cd (
3
) are as high as 1.945 g cm
3
at 163 K and 2.072 g cm
−3
at 298 K, respectively. Thermal analysis by the DSC-TG test shows that they all have good thermal stability with the highest decomposition temperatures of 287 °C and 344 °C, respectively. These two as-synthesized complexes exhibit excellent detonation performance;
2
(
D
= 8682 m s
−1
,
P
= 34.98 GPa) and
3
(
D
= 8383 m s
−1
,
P
= 33.78 GPa) have good detonation velocity and detonation pressure that are superior to those of TNT, which is widely used today. Thus, they show great promise for potential applications as thermally stable energetic materials.
Two thermally stable complexes based on DAPO were synthesized. The thermal decomposition temperatures were 287 °C and 344 °C, respectively. The detonation properties of the complexes were excellent with good detonation velocity and detonation pressure superior to that of TNT.</description><identifier>ISSN: 1466-8033</identifier><identifier>EISSN: 1466-8033</identifier><identifier>DOI: 10.1039/d2ce00715k</identifier><language>eng</language><publisher>Cambridge: Royal Society of Chemistry</publisher><subject>Coordination compounds ; Detonation ; Energetic materials ; Infrared spectroscopy ; Ligands ; Metal-organic frameworks ; NMR ; Nuclear magnetic resonance ; Single crystals ; Synthesis ; Thermal analysis ; Thermal stability</subject><ispartof>CrystEngComm, 2022-08, Vol.24 (3), p.5519-5526</ispartof><rights>Copyright Royal Society of Chemistry 2022</rights><lds50>peer_reviewed</lds50><woscitedreferencessubscribed>false</woscitedreferencessubscribed><citedby>FETCH-LOGICAL-c281t-d4a9654916a0acb9a878d17cac0a88540ab738e57c104e0d8cf47acd7e2c10593</citedby><cites>FETCH-LOGICAL-c281t-d4a9654916a0acb9a878d17cac0a88540ab738e57c104e0d8cf47acd7e2c10593</cites><orcidid>0000-0001-7057-2862</orcidid></display><links><openurl>$$Topenurl_article</openurl><openurlfulltext>$$Topenurlfull_article</openurlfulltext><thumbnail>$$Tsyndetics_thumb_exl</thumbnail><link.rule.ids>314,780,784,27924,27925</link.rule.ids></links><search><creatorcontrib>Zhang, Lu</creatorcontrib><creatorcontrib>Dong, Wen-Shuai</creatorcontrib><creatorcontrib>Lu, Zu-Jia</creatorcontrib><creatorcontrib>Wang, Ting-Wei</creatorcontrib><creatorcontrib>Zhang, Chao</creatorcontrib><creatorcontrib>Zhou, Zun-Ning</creatorcontrib><creatorcontrib>Zhang, Jian-Guo</creatorcontrib><title>Synthesis and characterization of thermally stable energetic complexes with 3,5-diaminopyrazolone-4-oxime as a nitrogen-rich ligand</title><title>CrystEngComm</title><description>Energetic metal organic frameworks (EMOFs) are increasingly developed and have proven to be candidates for novel high energy density materials (HEDM). Here, two energetic metal complexes based on 3,5-diaminopyrazolone-4-oxime (DAPO) ligands were synthesized by simple steps and fully characterized by NMR and IR spectroscopy, X-ray single-crystal diffraction, and DSC-TG. The detonation performance was calculated using the Kamlet-Jacobs formula. The crystal densities of these complexes (C
6
H
14
N
12
O
10
Co (
2
) and C
6
H
14
N
12
O
10
Cd (
3
) are as high as 1.945 g cm
3
at 163 K and 2.072 g cm
−3
at 298 K, respectively. Thermal analysis by the DSC-TG test shows that they all have good thermal stability with the highest decomposition temperatures of 287 °C and 344 °C, respectively. These two as-synthesized complexes exhibit excellent detonation performance;
2
(
D
= 8682 m s
−1
,
P
= 34.98 GPa) and
3
(
D
= 8383 m s
−1
,
P
= 33.78 GPa) have good detonation velocity and detonation pressure that are superior to those of TNT, which is widely used today. Thus, they show great promise for potential applications as thermally stable energetic materials.
Two thermally stable complexes based on DAPO were synthesized. The thermal decomposition temperatures were 287 °C and 344 °C, respectively. The detonation properties of the complexes were excellent with good detonation velocity and detonation pressure superior to that of TNT.</description><subject>Coordination compounds</subject><subject>Detonation</subject><subject>Energetic materials</subject><subject>Infrared spectroscopy</subject><subject>Ligands</subject><subject>Metal-organic frameworks</subject><subject>NMR</subject><subject>Nuclear magnetic resonance</subject><subject>Single crystals</subject><subject>Synthesis</subject><subject>Thermal analysis</subject><subject>Thermal stability</subject><issn>1466-8033</issn><issn>1466-8033</issn><fulltext>true</fulltext><rsrctype>article</rsrctype><creationdate>2022</creationdate><recordtype>article</recordtype><recordid>eNpNkU1PwzAMhisEEmNw4Y4UiRuikLRp0x7RGB9iEgfgXHmpu2a0SUkyse7KH6cwBJxs2Y_8SK-D4JjRC0bj_LKMJFIqWPK6E4wYT9Mwo3G8-6_fDw6cW1LKOGN0FHw89drX6JQjoEsia7AgPVq1Aa-MJqYiw9q20DQ9cR7mDRLUaBfolSTStF2Da3TkXfmaxOdJWCpolTZdb2FjGqMx5KFZqxYJDAqilbdmgTq0StakUYvBehjsVdA4PPqp4-DlZvo8uQtnj7f3k6tZKKOM-bDkkKcJz1kKFOQ8h0xkJRMSJIUsSziFuYgzTIRklCMtM1lxAbIUGA2TJI_Hwen2bmfN2wqdL5ZmZfWgLKI0F5QJnvCBOttS0hrnLFZFZ1ULti8YLb5CLq6jyfQ75IcBPtnC1slf7u8J8SfRF3sy</recordid><startdate>20220801</startdate><enddate>20220801</enddate><creator>Zhang, Lu</creator><creator>Dong, Wen-Shuai</creator><creator>Lu, Zu-Jia</creator><creator>Wang, Ting-Wei</creator><creator>Zhang, Chao</creator><creator>Zhou, Zun-Ning</creator><creator>Zhang, Jian-Guo</creator><general>Royal Society of Chemistry</general><scope>AAYXX</scope><scope>CITATION</scope><scope>7U5</scope><scope>8FD</scope><scope>L7M</scope><orcidid>https://orcid.org/0000-0001-7057-2862</orcidid></search><sort><creationdate>20220801</creationdate><title>Synthesis and characterization of thermally stable energetic complexes with 3,5-diaminopyrazolone-4-oxime as a nitrogen-rich ligand</title><author>Zhang, Lu ; Dong, Wen-Shuai ; Lu, Zu-Jia ; Wang, Ting-Wei ; Zhang, Chao ; Zhou, Zun-Ning ; Zhang, Jian-Guo</author></sort><facets><frbrtype>5</frbrtype><frbrgroupid>cdi_FETCH-LOGICAL-c281t-d4a9654916a0acb9a878d17cac0a88540ab738e57c104e0d8cf47acd7e2c10593</frbrgroupid><rsrctype>articles</rsrctype><prefilter>articles</prefilter><language>eng</language><creationdate>2022</creationdate><topic>Coordination compounds</topic><topic>Detonation</topic><topic>Energetic materials</topic><topic>Infrared spectroscopy</topic><topic>Ligands</topic><topic>Metal-organic frameworks</topic><topic>NMR</topic><topic>Nuclear magnetic resonance</topic><topic>Single crystals</topic><topic>Synthesis</topic><topic>Thermal analysis</topic><topic>Thermal stability</topic><toplevel>peer_reviewed</toplevel><toplevel>online_resources</toplevel><creatorcontrib>Zhang, Lu</creatorcontrib><creatorcontrib>Dong, Wen-Shuai</creatorcontrib><creatorcontrib>Lu, Zu-Jia</creatorcontrib><creatorcontrib>Wang, Ting-Wei</creatorcontrib><creatorcontrib>Zhang, Chao</creatorcontrib><creatorcontrib>Zhou, Zun-Ning</creatorcontrib><creatorcontrib>Zhang, Jian-Guo</creatorcontrib><collection>CrossRef</collection><collection>Solid State and Superconductivity Abstracts</collection><collection>Technology Research Database</collection><collection>Advanced Technologies Database with Aerospace</collection><jtitle>CrystEngComm</jtitle></facets><delivery><delcategory>Remote Search Resource</delcategory><fulltext>fulltext</fulltext></delivery><addata><au>Zhang, Lu</au><au>Dong, Wen-Shuai</au><au>Lu, Zu-Jia</au><au>Wang, Ting-Wei</au><au>Zhang, Chao</au><au>Zhou, Zun-Ning</au><au>Zhang, Jian-Guo</au><format>journal</format><genre>article</genre><ristype>JOUR</ristype><atitle>Synthesis and characterization of thermally stable energetic complexes with 3,5-diaminopyrazolone-4-oxime as a nitrogen-rich ligand</atitle><jtitle>CrystEngComm</jtitle><date>2022-08-01</date><risdate>2022</risdate><volume>24</volume><issue>3</issue><spage>5519</spage><epage>5526</epage><pages>5519-5526</pages><issn>1466-8033</issn><eissn>1466-8033</eissn><abstract>Energetic metal organic frameworks (EMOFs) are increasingly developed and have proven to be candidates for novel high energy density materials (HEDM). Here, two energetic metal complexes based on 3,5-diaminopyrazolone-4-oxime (DAPO) ligands were synthesized by simple steps and fully characterized by NMR and IR spectroscopy, X-ray single-crystal diffraction, and DSC-TG. The detonation performance was calculated using the Kamlet-Jacobs formula. The crystal densities of these complexes (C
6
H
14
N
12
O
10
Co (
2
) and C
6
H
14
N
12
O
10
Cd (
3
) are as high as 1.945 g cm
3
at 163 K and 2.072 g cm
−3
at 298 K, respectively. Thermal analysis by the DSC-TG test shows that they all have good thermal stability with the highest decomposition temperatures of 287 °C and 344 °C, respectively. These two as-synthesized complexes exhibit excellent detonation performance;
2
(
D
= 8682 m s
−1
,
P
= 34.98 GPa) and
3
(
D
= 8383 m s
−1
,
P
= 33.78 GPa) have good detonation velocity and detonation pressure that are superior to those of TNT, which is widely used today. Thus, they show great promise for potential applications as thermally stable energetic materials.
Two thermally stable complexes based on DAPO were synthesized. The thermal decomposition temperatures were 287 °C and 344 °C, respectively. The detonation properties of the complexes were excellent with good detonation velocity and detonation pressure superior to that of TNT.</abstract><cop>Cambridge</cop><pub>Royal Society of Chemistry</pub><doi>10.1039/d2ce00715k</doi><tpages>8</tpages><orcidid>https://orcid.org/0000-0001-7057-2862</orcidid></addata></record> |
| fulltext | fulltext |
| identifier | ISSN: 1466-8033 |
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| language | eng |
| recordid | cdi_proquest_journals_2697017454 |
| source | Royal Society of Chemistry |
| subjects | Coordination compounds Detonation Energetic materials Infrared spectroscopy Ligands Metal-organic frameworks NMR Nuclear magnetic resonance Single crystals Synthesis Thermal analysis Thermal stability |
| title | Synthesis and characterization of thermally stable energetic complexes with 3,5-diaminopyrazolone-4-oxime as a nitrogen-rich ligand |
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