Crystal structure and Hirshfeld surface analysis of 1-(<i>tert</i>-butylamino)-3-mesitylpropan-2-ol hemihydrate

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Khalilov A. N., Khrustalev V. N., Tereshina T. A., AKKURT M., Rzayev R., Akobirshoeva A. A., ...daha çox

ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, vol.78, pp.525-529, 2022 (ESCI)

• Nəşrin Növü: Article / Article
• Cild: 78
• Nəşr tarixi: 2022
• Doi nömrəsi: 10.1107/s2056989022004297
• jurnalın adı: ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS
• Jurnalın baxıldığı indekslər: Emerging Sources Citation Index (ESCI), Scopus
• Səhifə sayı: pp.525-529
• Adres: Bəli

Qısa məlumat

The title compound, 2C(16)H(27)NO center dot H2O, crystallizes in the monoclinic P2(1)/c space group with two independent molecules (A and B) in the asymmetric unit. In the crystal, molecules A and B are linked through the water molecules by intermolecular O-H center dot center dot center dot O and O-H center dot center dot center dot N hydrogen bonds, producing chains along the b-axis direction. These chains are linked with neighboring chains parallel to the (103) plane via C-H center dot center dot center dot pi interactions, generating ribbons along the b-axis direction. The stability of the molecular packaging is ensured by van der Waals interactions between the ribbons. According to the Hirshfeld surface study, H center dot center dot center dot H interactions are the most significant contributors to the crystal packing (80.3% for molecule A and 84.8% for molecule B).