The X-ray Structures of [Fe(CO)3(η4-6-exo-(OH/D)cyclohepta-2,4-dien-1-one]

Abstract The structures of [Fe(CO) 3 (η 4 -6- exo -(OH)cyclohepta-2,4-dien-1-one] [monoclinic, a = 6.6080(2), b = 11.9177(3), c = 13.1157(4), β = 102.590(3) space group P2 1 /c] and [Fe(CO) 3 (η 4 -6- exo -(OD)cyclohepta-2,4-dien-1-one] [monoclinic, a = 6.5999(3), b = 11.8947(4), c = 13.1040(5), β = 102.497(4) space group P2 1 /c] have been determined. There is moderate intermolecular hydrogen bonding observed between the alcohol and the ketone. The iron centers adopt a slightly distorted square pyramidal geometry. Graphical Abstract

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Publication Details

Journal
Journal of Chemical Crystallography
Published
2025-11-11
DOI
https://doi.org/10.1007/s10870-025-01064-3
Primary Topic
Metal-Catalyzed Oxygenation Mechanisms
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article
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article

The X-ray Structures of [Fe(CO)3(η4-6-exo-(OH/D)cyclohepta-2,4-dien-1-one]

Chip Nataro, Gillian Schwanitz, Daniel R. Griffith
Journal of Chemical Crystallography
Metal-Catalyzed Oxygenation Mechanisms
article

The X-ray Structures of [Fe(CO)3(η4-6-exo-(OH/D)cyclohepta-2,4-dien-1-one]

Chip Nataro, Gillian Schwanitz, Daniel R. Griffith
article en

Abstract

Abstract The structures of [Fe(CO) 3 (η 4 -6- exo -(OH)cyclohepta-2,4-dien-1-one] [monoclinic, a = 6.6080(2), b = 11.9177(3), c = 13.1157(4), β = 102.590(3) space group P2 1 /c] and [Fe(CO) 3 (η 4 -6- exo -(OD)cyclohepta-2,4-dien-1-one] [monoclinic, a = 6.5999(3), b = 11.8947(4), c = 13.1040(5), β = 102.497(4) space group P2 1 /c] have been determined. There is moderate intermolecular hydrogen bonding observed between the alcohol and the ketone. The iron centers adopt a slightly distorted square pyramidal geometry. Graphical Abstract

Journal of Chemical CrystallographyVol. 56(1)
Lafayette College (US)
Openalex Percentile: Top 71%
Metal-Catalyzed Oxygenation Mechanisms
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