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1-Acetyl-3-ferrocenyl-5-(2-nitro-phen-yl)-2-pyrazoline.

Turgut Cin G, Demirel S, Karadayı N, Büyükgüngör O - Acta Crystallogr Sect E Struct Rep Online (2008)

Bottom Line: The mol-ecules in the crystal structure are held together by three inter-molecular C-H⋯O hydrogen bonds.There is also an intra-molecular C-H⋯N hydrogen bond.The H atoms of the methyl group are disordered equally over two positions.

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ABSTRACT
In the title compound, [Fe(C(5)H(5))(C(16)H(14)N(3)O(3))], the pyrazoline ring and the substituted cyclo-penta-dienyl ring are nearly coplanar, with a dihedral angle of 8.17 (2)°, while the nitro-substituted benzene ring is twisted out of the pyrazoline ring plane by 70.76 (1)°. The mol-ecules in the crystal structure are held together by three inter-molecular C-H⋯O hydrogen bonds. There is also an intra-molecular C-H⋯N hydrogen bond. The H atoms of the methyl group are disordered equally over two positions.

No MeSH data available.


The molecular structure of the title compound. Displacement ellipsoids are drawn at the 50% probability level.
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Fap1: The molecular structure of the title compound. Displacement ellipsoids are drawn at the 50% probability level.


1-Acetyl-3-ferrocenyl-5-(2-nitro-phen-yl)-2-pyrazoline.

Turgut Cin G, Demirel S, Karadayı N, Büyükgüngör O - Acta Crystallogr Sect E Struct Rep Online (2008)

The molecular structure of the title compound. Displacement ellipsoids are drawn at the 50% probability level.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC2960933&req=5

Fap1: The molecular structure of the title compound. Displacement ellipsoids are drawn at the 50% probability level.
Bottom Line: The mol-ecules in the crystal structure are held together by three inter-molecular C-H⋯O hydrogen bonds.There is also an intra-molecular C-H⋯N hydrogen bond.The H atoms of the methyl group are disordered equally over two positions.

View Article: PubMed Central - HTML - PubMed

ABSTRACT
In the title compound, [Fe(C(5)H(5))(C(16)H(14)N(3)O(3))], the pyrazoline ring and the substituted cyclo-penta-dienyl ring are nearly coplanar, with a dihedral angle of 8.17 (2)°, while the nitro-substituted benzene ring is twisted out of the pyrazoline ring plane by 70.76 (1)°. The mol-ecules in the crystal structure are held together by three inter-molecular C-H⋯O hydrogen bonds. There is also an intra-molecular C-H⋯N hydrogen bond. The H atoms of the methyl group are disordered equally over two positions.

No MeSH data available.