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3-(3-Chloro-prop-yl)-7,8-dimeth-oxy-1H-3-benzazepin-2(3H)-one at 125 K.

Cheng XW - Acta Crystallogr Sect E Struct Rep Online (2008)

Bottom Line: It adopts a bent conformation, inter-mediate between the boat and chair forms.Both meth-oxy groups are coplanar with the attached benzene ring [C-C-O-C = -0.5 (3) and 2.2 (3)°].In the crystal structure, inversion-related mol-ecules are linked via C-H⋯O hydrogen bonds and π-π inter-actions involving the benzene ring [centroid-centroid distance = 3.6393 (12)Å].

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Affiliation: Zhejiang Police College Experience Center, Zhejiang Police College, Hangzhou 310053, People's Republic of China.

ABSTRACT
In the title compound, C(15)H(18)ClNO(3), the seven-membered ring has a mirror plane passing through the methyl-ene C atom and bis-ecting the C=C bond. It adopts a bent conformation, inter-mediate between the boat and chair forms. Both meth-oxy groups are coplanar with the attached benzene ring [C-C-O-C = -0.5 (3) and 2.2 (3)°]. In the crystal structure, inversion-related mol-ecules are linked via C-H⋯O hydrogen bonds and π-π inter-actions involving the benzene ring [centroid-centroid distance = 3.6393 (12)Å].

No MeSH data available.


Molecular structure of the title compound, showing 30% probability displacement ellipsoids and the atomic numbering.
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Fap1: Molecular structure of the title compound, showing 30% probability displacement ellipsoids and the atomic numbering.


3-(3-Chloro-prop-yl)-7,8-dimeth-oxy-1H-3-benzazepin-2(3H)-one at 125 K.

Cheng XW - Acta Crystallogr Sect E Struct Rep Online (2008)

Molecular structure of the title compound, showing 30% probability displacement ellipsoids and the atomic numbering.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC2961294&req=5

Fap1: Molecular structure of the title compound, showing 30% probability displacement ellipsoids and the atomic numbering.
Bottom Line: It adopts a bent conformation, inter-mediate between the boat and chair forms.Both meth-oxy groups are coplanar with the attached benzene ring [C-C-O-C = -0.5 (3) and 2.2 (3)°].In the crystal structure, inversion-related mol-ecules are linked via C-H⋯O hydrogen bonds and π-π inter-actions involving the benzene ring [centroid-centroid distance = 3.6393 (12)Å].

View Article: PubMed Central - HTML - PubMed

Affiliation: Zhejiang Police College Experience Center, Zhejiang Police College, Hangzhou 310053, People's Republic of China.

ABSTRACT
In the title compound, C(15)H(18)ClNO(3), the seven-membered ring has a mirror plane passing through the methyl-ene C atom and bis-ecting the C=C bond. It adopts a bent conformation, inter-mediate between the boat and chair forms. Both meth-oxy groups are coplanar with the attached benzene ring [C-C-O-C = -0.5 (3) and 2.2 (3)°]. In the crystal structure, inversion-related mol-ecules are linked via C-H⋯O hydrogen bonds and π-π inter-actions involving the benzene ring [centroid-centroid distance = 3.6393 (12)Å].

No MeSH data available.