Synthesis, Crystal Structure and Hirshfeld Surface (HS) Analysis of Two New Phosphoric Triamides: A Comparison of HSs for Structures with Different Molecular Assemblies

Keikha, Mojtaba; Pourayoubi, Mehrdad; Lee, Arie van der

doi:10.1007/s10870-019-00776-7

Cited by 4 publications

(3 citation statements)

References 25 publications

Supporting

Mentioning

Contrasting

Order By: Relevance

“…Red and blue represent the high and low intensities of interaction, respectively. 30,35,50 In the two-dimensional fingerprint plots, the decreasing order of close contact is H⋯O > N⋯O > O⋯O > N⋯H > C⋯O. Combined with the Hirshfeld surface, strong interactions appear between NO 2 or carbonyl and hydrogen on the triazole ring.…”

Section: Crystal Structurementioning

confidence: 99%

Study on the crystal structure and properties of a new crystal form of 3-nitro-1,2,4-triazole-5-one (NTO)

Wang,

Zhang,

Wang

et al. 2024

CrystEngComm

View full text Add to dashboard Cite

show abstract

Section: Crystal Structurementioning

confidence: 99%

Study on the crystal structure and properties of a new crystal form of 3-nitro-1,2,4-triazole-5-one (NTO)

Wang,

Zhang,

Wang

et al. 2024

CrystEngComm

View full text Add to dashboard Cite

show abstract

“…Molecular Hirshfeld surface calculations were performed using the CrystalExplorer 17.5 program [32]. Scanning electron microscopic (SEM) investigations were carried out using an FEI QUNTA eld emission gun 650; prior to the SEM examination the specimens were sputter coated with gold.…”

Section: Introductionmentioning

confidence: 99%

A Cobalt-Organic Framework with Sensitive Detection of Fe3+, Cr2O72–, and CrO42– Ions in Water

Zhang

Sun

et al. 2021

J Inorg Organomet Polym

View full text Add to dashboard Cite

A six-coordinated 3D metal-organic framework (MOF), namely, [Co(BPDC)(3-bpdb)(H 2 O) 2 ] n (1) (H 2 BPDC = 4,4′-biphenyldicarboxylic acid, 3-bpdb = 1,4-bis(3-pyridyl)-2,3-diaza-1,3-butadiene) was purposefully constructed and characterized by single-crystal XRD, IR, elemental analyses, PXRD, SEM, and TGA. Crystal structural analysis revealed that the complex consists of a cds-type three-fold interpenetrated framework.Hirshfeld surface analysis yielded details of the surface characteristics of 1. Signi cant O−H•••O hydrogen bonding interactions, which could promote the stability of the framework, were found is extremely stable in aqueous solution and can resist acids and bases over an extensive pH range of 2 -13. 1 shows brilliant uorescent emission in the solid state and in aqueous solution. Fluorescence titration, cyclic, and antiinterference experiments demonstrated that 1 is an excellent probe for Fe 3+ , CrO 4 2and Cr 2 O 7 2in water.The K sv values of 1 for Fe 3+ , CrO 4 2-, and Cr 2 O 7 2-, which were as high as 1.06 × 10 4 M −1 , 1.50 × 10 4 M −1 , and 1.16 × 10 4 M −1 , respectively, were comparable with those of other sensors. The quenching mechanism of the novel probe was subsequently explained.

show abstract

“…The UV-Vis spectra were obtained using UV-240 IPC spectrophotometer. TGA data were acquired using a Mettler-Toledo simultaneous thermal analyzer from room temperature to 800 °C under an N 2 atmosphere with a heating rate of 10 °C min − 1 .Molecular Hirshfeld surface calculations were performed using the CrystalExplorer 17.5 program[32]. Scanning electron microscopic (SEM) investigations were carried out using an FEI QUNTA eld emission gun 650; prior to the SEM examination the specimens were sputter coated with gold.…”

mentioning

confidence: 99%

A cobalt-organic framework with sensitive detection of Fe3+, Cr2O72–, and CrO42– ions in water

Zhang

Sun

et al. 2021

Preprint

View full text Add to dashboard Cite

A six-coordinated 3D metal–organic framework (MOF), namely, [Co(BPDC)(3-bpdb)(H2O)2]n (1) (H2BPDC = 4,4′-biphenyldicarboxylic acid, 3-bpdb = 1,4-bis(3-pyridyl)-2,3-diaza-1,3-butadiene) was purposefully constructed and characterized by single-crystal XRD, IR, elemental analyses, PXRD, SEM, and TGA. Crystal structural analysis revealed that the complex consists of a cds-type three-fold interpenetrated framework. Hirshfeld surface analysis yielded details of the surface characteristics of 1. Significant O−H···O hydrogen bonding interactions, which could promote the stability of the framework, were found is extremely stable in aqueous solution and can resist acids and bases over an extensive pH range of 2 - 13. 1 shows brilliant fluorescent emission in the solid state and in aqueous solution. Fluorescence titration, cyclic, and anti-interference experiments demonstrated that 1 is an excellent probe for Fe3+, CrO42‒ and Cr2O72‒ in water. The Ksv values of 1 for Fe3+, CrO42‒, and Cr2O72‒, which were as high as 1.06 × 104 M−1, 1.50 × 104 M−1, and 1.16 × 104 M−1, respectively, were comparable with those of other sensors. The quenching mechanism of the novel probe was subsequently explained.

show abstract

Synthesis, Crystal Structure and Hirshfeld Surface (HS) Analysis of Two New Phosphoric Triamides: A Comparison of HSs for Structures with Different Molecular Assemblies

Cited by 4 publications

References 25 publications

Study on the crystal structure and properties of a new crystal form of 3-nitro-1,2,4-triazole-5-one (NTO)

Study on the crystal structure and properties of a new crystal form of 3-nitro-1,2,4-triazole-5-one (NTO)

A Cobalt-Organic Framework with Sensitive Detection of Fe3+, Cr2O72–, and CrO42– Ions in Water

A cobalt-organic framework with sensitive detection of Fe3+, Cr2O72–, and CrO42– ions in water

Contact Info

Product

Resources

About