A new series of 3,5-diamino-1,2,4-triazolium(1+) inorganic salts and their potential in crystal engineering of novel NLO materials

Kód výsledku v IS VaVaI

<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F68378271%3A_____%2F12%3A00390824" target="_blank" >RIV/68378271:_____/12:00390824 - isvavai.cz</a>

Nalezeny alternativní kódy

RIV/00216208:11310/12:10121180

Výsledek na webu

<a href="http://dx.doi.org/10.1039/c2ce00024e" target="_blank" >http://dx.doi.org/10.1039/c2ce00024e</a>

DOI - Digital Object Identifier

<a href="http://dx.doi.org/10.1039/c2ce00024e" target="_blank" >10.1039/c2ce00024e</a>

Jazyk výsledku

angličtina

Název v původním jazyce

A new series of 3,5-diamino-1,2,4-triazolium(1+) inorganic salts and their potential in crystal engineering of novel NLO materials

Popis výsledku v původním jazyce

A new series of 3,5-diaminotriazolium inorganic salts and their potential in crystal engineering of novel NLO materials. Seven inorganic salts of 3,5-diaminotriazole with inorganic acids were prepared within our project focused on the crystal engineeringof novel NLO materials and their X-ray structures were determined. Three triclinic compounds, selenate dihydrate, sulphate dihydrate and perchlorate. Three monoclinic structures of dat - i.e. nitrate, chloride hemihydrate and hydrogen phosphite. Finally, the most promising structure of dat dihydrogen phosphate is orthorhombic (the space group Fdd2). The FTIR and Raman spectra of the title compounds have been recorded and discussed. The assignment of the spectra is based on a quantum-chemical calculation and the factor group analysis. Quantitative powder measurements of the second harmonic generation of the only non-centrosymmetric dat dihydrogen phosphate at 1064 nm were performed and a relative efficiency equal to KDP was observed.

Název v anglickém jazyce

A new series of 3,5-diamino-1,2,4-triazolium(1+) inorganic salts and their potential in crystal engineering of novel NLO materials

Popis výsledku anglicky

A new series of 3,5-diaminotriazolium inorganic salts and their potential in crystal engineering of novel NLO materials. Seven inorganic salts of 3,5-diaminotriazole with inorganic acids were prepared within our project focused on the crystal engineeringof novel NLO materials and their X-ray structures were determined. Three triclinic compounds, selenate dihydrate, sulphate dihydrate and perchlorate. Three monoclinic structures of dat - i.e. nitrate, chloride hemihydrate and hydrogen phosphite. Finally, the most promising structure of dat dihydrogen phosphate is orthorhombic (the space group Fdd2). The FTIR and Raman spectra of the title compounds have been recorded and discussed. The assignment of the spectra is based on a quantum-chemical calculation and the factor group analysis. Quantitative powder measurements of the second harmonic generation of the only non-centrosymmetric dat dihydrogen phosphate at 1064 nm were performed and a relative efficiency equal to KDP was observed.

Druh

J_x - Nezařazeno - Článek v odborném periodiku (Jimp, Jsc a Jost)

CEP obor

BM - Fyzika pevných látek a magnetismus

OECD FORD obor

—

Projekt

<a href="/cs/project/GA203%2F09%2F0878" target="_blank" >GA203/09/0878: Krystalové inženýrství materiálů s vodíkovými vazbami pro nelineární optiku</a><br>

Návaznosti

Z - Vyzkumny zamer (s odkazem do CEZ)

Rok uplatnění

2012

Kód důvěrnosti údajů

S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Název periodika

CrystEngComm

ISSN

1466-8033

e-ISSN

—

Svazek periodika

14

Číslo periodika v rámci svazku

14

Stát vydavatele periodika

GB - Spojené království Velké Británie a Severního Irska

Počet stran výsledku

12

Strana od-do

4625-4636

Kód UT WoS článku

000305530500014

EID výsledku v databázi Scopus

—