Crystal structure and Hirshfeld surface analysis of (Z)-N-{chloro[(4-ferrocenylphenyl)imino]methyl}-4-ferrocenylaniline N,N-dimethylformamide monosolvate

Riham Sghyar; Abdeslem Bentama; Amal Haoudi; Ahmed Mazzah; Joel T. Mague; Tuncer Hökelek; El Mestafa EL Hadrami; Nada Kheira Sebbar

doi:10.1107/S2056989024001002

Crystal structure and Hirshfeld surface analysis of (Z)-N-{chloro[(4-ferrocenylphenyl)imino]methyl}-4-ferrocenylaniline N,N-dimethylformamide monosolvate

Riham Sghyar
, Abdeslem Bentama
, Amal Haoudi
, Ahmed Mazzah
, Joel T. Mague
, Tuncer Hökelek
, El Mestafa EL Hadrami
, Nada Kheira Sebbar

Hacettepe University

Sidi Mohamed Ben Abdellah University
Science and Technology of Lille USR 3290
Tulane University
Ibn Zohr University
Mohammed V University in Rabat

Research output: Contribution to journal › Article › peer-review

1 Citation (Scopus)

Abstract

The title molecule, [Fe₂(C₅H₅)₂(C₂₃H₁₇ClN₂)]·C₃H₇NO, is twisted end to end and the central N/C/N unit is disordered. In the crystal, several C—H. . .π(ring) interactions lead to the formation of layers, which are connected by further C—H. . .π(ring) interactions. A Hirshfeld surface analysis of the crystal structure indicates that the most important contributions for the crystal packing are from H. . .H (60.2%) and H. . .C/C. . .H (27.0%) interactions. Hydrogen bonding, C—H. . .π(ring) interactions and van der Waals interactions dominate the crystal packing.

Original language	English
Pages (from-to)	262-266
Number of pages	5
Journal	Acta Crystallographica Section E: Crystallographic Communications
Volume	80
Issue number	Pt 3
DOIs	https://doi.org/10.1107/S2056989024001002
Publication status	Published - 1 Mar 2024

Keywords

C—H. . .π(ring) interactions
carbamidic chloride
crystal structure
ferrocene
hydrogen bond

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10.1107/S2056989024001002

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Sghyar, R., Bentama, A., Haoudi, A., Mazzah, A., Mague, J. T., Hökelek, T., EL Hadrami, E. M., & Sebbar, N. K. (2024). Crystal structure and Hirshfeld surface analysis of (Z)-N-{chloro[(4-ferrocenylphenyl)imino]methyl}-4-ferrocenylaniline N,N-dimethylformamide monosolvate. Acta Crystallographica Section E: Crystallographic Communications, 80(Pt 3), 262-266. https://doi.org/10.1107/S2056989024001002

@article{00078ba2cc6146a5968871128d362c48,

title = "Crystal structure and Hirshfeld surface analysis of (Z)-N-\{chloro[(4-ferrocenylphenyl)imino]methyl\}-4-ferrocenylaniline N,N-dimethylformamide monosolvate",

abstract = "The title molecule, [Fe2(C5H5)2(C23H17ClN2)]·C3H7NO, is twisted end to end and the central N/C/N unit is disordered. In the crystal, several C—H. . .π(ring) interactions lead to the formation of layers, which are connected by further C—H. . .π(ring) interactions. A Hirshfeld surface analysis of the crystal structure indicates that the most important contributions for the crystal packing are from H. . .H (60.2\%) and H. . .C/C. . .H (27.0\%) interactions. Hydrogen bonding, C—H. . .π(ring) interactions and van der Waals interactions dominate the crystal packing.",

keywords = "C—H. . .π(ring) interactions, carbamidic chloride, crystal structure, ferrocene, hydrogen bond",

author = "Riham Sghyar and Abdeslem Bentama and Amal Haoudi and Ahmed Mazzah and Mague, \{Joel T.\} and Tuncer H{\"o}kelek and \{EL Hadrami\}, \{El Mestafa\} and Sebbar, \{Nada Kheira\}",

year = "2024",

month = mar,

day = "1",

doi = "10.1107/S2056989024001002",

language = "English",

volume = "80",

pages = "262--266",

journal = "Acta Crystallographica Section E: Crystallographic Communications",

issn = "2056-9890",

publisher = "International Union of Crystallography",

number = "Pt 3",

}

Sghyar, R, Bentama, A, Haoudi, A, Mazzah, A, Mague, JT, Hökelek, T, EL Hadrami, EM & Sebbar, NK 2024, 'Crystal structure and Hirshfeld surface analysis of (Z)-N-{chloro[(4-ferrocenylphenyl)imino]methyl}-4-ferrocenylaniline N,N-dimethylformamide monosolvate', Acta Crystallographica Section E: Crystallographic Communications, vol. 80, no. Pt 3, pp. 262-266. https://doi.org/10.1107/S2056989024001002

Crystal structure and Hirshfeld surface analysis of (Z)-N-{chloro[(4-ferrocenylphenyl)imino]methyl}-4-ferrocenylaniline N,N-dimethylformamide monosolvate. / Sghyar, Riham; Bentama, Abdeslem; Haoudi, Amal et al.
In: Acta Crystallographica Section E: Crystallographic Communications, Vol. 80, No. Pt 3, 01.03.2024, p. 262-266.

Research output: Contribution to journal › Article › peer-review

TY - JOUR

T1 - Crystal structure and Hirshfeld surface analysis of (Z)-N-{chloro[(4-ferrocenylphenyl)imino]methyl}-4-ferrocenylaniline N,N-dimethylformamide monosolvate

AU - Sghyar, Riham

AU - Bentama, Abdeslem

AU - Haoudi, Amal

AU - Mazzah, Ahmed

AU - Mague, Joel T.

AU - Hökelek, Tuncer

AU - EL Hadrami, El Mestafa

AU - Sebbar, Nada Kheira

PY - 2024/3/1

Y1 - 2024/3/1

N2 - The title molecule, [Fe2(C5H5)2(C23H17ClN2)]·C3H7NO, is twisted end to end and the central N/C/N unit is disordered. In the crystal, several C—H. . .π(ring) interactions lead to the formation of layers, which are connected by further C—H. . .π(ring) interactions. A Hirshfeld surface analysis of the crystal structure indicates that the most important contributions for the crystal packing are from H. . .H (60.2%) and H. . .C/C. . .H (27.0%) interactions. Hydrogen bonding, C—H. . .π(ring) interactions and van der Waals interactions dominate the crystal packing.

AB - The title molecule, [Fe2(C5H5)2(C23H17ClN2)]·C3H7NO, is twisted end to end and the central N/C/N unit is disordered. In the crystal, several C—H. . .π(ring) interactions lead to the formation of layers, which are connected by further C—H. . .π(ring) interactions. A Hirshfeld surface analysis of the crystal structure indicates that the most important contributions for the crystal packing are from H. . .H (60.2%) and H. . .C/C. . .H (27.0%) interactions. Hydrogen bonding, C—H. . .π(ring) interactions and van der Waals interactions dominate the crystal packing.

KW - C—H. . .π(ring) interactions

KW - carbamidic chloride

KW - crystal structure

KW - ferrocene

KW - hydrogen bond

UR - https://www.scopus.com/pages/publications/85187704057

U2 - 10.1107/S2056989024001002

DO - 10.1107/S2056989024001002

M3 - Article

C2 - 38456046

AN - SCOPUS:85187704057

SN - 2056-9890

VL - 80

SP - 262

EP - 266

JO - Acta Crystallographica Section E: Crystallographic Communications

JF - Acta Crystallographica Section E: Crystallographic Communications

IS - Pt 3

ER -

Crystal structure and Hirshfeld surface analysis of (Z)-N-{chloro[(4-ferrocenylphenyl)imino]methyl}-4-ferrocenylaniline N,N-dimethylformamide monosolvate

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Keywords

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