6-[(2E)-3,7-Dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one–6-[(2E)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2H-chromen-2-one (1/1) from Mesua elegans

The title co-crystal, C30H34O5·C30H34O5, comprises a 1:1 mixture of two mostly superimposed mol­ecules with the same chemical formula that differ in the nature of the substituent (2-methyl­butanoyl or 3-methyl­butano­yl) bound at the exocyclic ketone. The lactone ring is close to planar (r.m.s. devi...

Full description

Saved in:
Bibliographic Details
Main Authors: Awang, Khalijah, Chan, G., Ismail, N.H., Ng, Seik Weng, Tiekink, Edward R.T.
Format: Article
Language:English
Published: International Union of Crystallography 2012
Subjects:
Online Access:http://eprints.um.edu.my/10495/1/6.pdf
http://eprints.um.edu.my/10495/
Tags: Add Tag
No Tags, Be the first to tag this record!
id my.um.eprints.10495
record_format eprints
spelling my.um.eprints.104952019-03-08T08:33:08Z http://eprints.um.edu.my/10495/ 6-[(2E)-3,7-Dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one–6-[(2E)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2H-chromen-2-one (1/1) from Mesua elegans Awang, Khalijah Chan, G. Ismail, N.H. Ng, Seik Weng Tiekink, Edward R.T. QD Chemistry The title co-crystal, C30H34O5·C30H34O5, comprises a 1:1 mixture of two mostly superimposed mol­ecules with the same chemical formula that differ in the nature of the substituent (2-methyl­butanoyl or 3-methyl­butano­yl) bound at the exocyclic ketone. The lactone ring is close to planar (r.m.s. deviation = 0.058 Å) and the phenyl ring is twisted out of this plane [dihedral angle = 60.08 (9)°]. The geranyl substituent is almost normal to benzene ring to which it is connected [C—C—Car—Car (ar = aromatic) torsion angle = −87.8 (2)°]. Intra­molecular O—H...O and O—H...π inter­actions are formed. In the crystal, supra­molecular chains are formed along the a axis owing to C—H...O contacts, with the lactone carbonyl atom accepting two such bonds. International Union of Crystallography 2012 Article PeerReviewed application/pdf en http://eprints.um.edu.my/10495/1/6.pdf Awang, Khalijah and Chan, G. and Ismail, N.H. and Ng, Seik Weng and Tiekink, Edward R.T. (2012) 6-[(2E)-3,7-Dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one–6-[(2E)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2H-chromen-2-one (1/1) from Mesua elegans. Acta Crystallographica Section E: Structure Reports Online, 68. 0939-0940. ISSN 1600-5368 doi: 10.1107/S1600536812008628
institution Universiti Malaya
building UM Library
collection Institutional Repository
continent Asia
country Malaysia
content_provider Universiti Malaya
content_source UM Research Repository
url_provider http://eprints.um.edu.my/
language English
topic QD Chemistry
spellingShingle QD Chemistry
Awang, Khalijah
Chan, G.
Ismail, N.H.
Ng, Seik Weng
Tiekink, Edward R.T.
6-[(2E)-3,7-Dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one–6-[(2E)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2H-chromen-2-one (1/1) from Mesua elegans
description The title co-crystal, C30H34O5·C30H34O5, comprises a 1:1 mixture of two mostly superimposed mol­ecules with the same chemical formula that differ in the nature of the substituent (2-methyl­butanoyl or 3-methyl­butano­yl) bound at the exocyclic ketone. The lactone ring is close to planar (r.m.s. deviation = 0.058 Å) and the phenyl ring is twisted out of this plane [dihedral angle = 60.08 (9)°]. The geranyl substituent is almost normal to benzene ring to which it is connected [C—C—Car—Car (ar = aromatic) torsion angle = −87.8 (2)°]. Intra­molecular O—H...O and O—H...π inter­actions are formed. In the crystal, supra­molecular chains are formed along the a axis owing to C—H...O contacts, with the lactone carbonyl atom accepting two such bonds.
format Article
author Awang, Khalijah
Chan, G.
Ismail, N.H.
Ng, Seik Weng
Tiekink, Edward R.T.
author_facet Awang, Khalijah
Chan, G.
Ismail, N.H.
Ng, Seik Weng
Tiekink, Edward R.T.
author_sort Awang, Khalijah
title 6-[(2E)-3,7-Dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one–6-[(2E)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2H-chromen-2-one (1/1) from Mesua elegans
title_short 6-[(2E)-3,7-Dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one–6-[(2E)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2H-chromen-2-one (1/1) from Mesua elegans
title_full 6-[(2E)-3,7-Dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one–6-[(2E)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2H-chromen-2-one (1/1) from Mesua elegans
title_fullStr 6-[(2E)-3,7-Dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one–6-[(2E)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2H-chromen-2-one (1/1) from Mesua elegans
title_full_unstemmed 6-[(2E)-3,7-Dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2H-chromen-2-one–6-[(2E)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2H-chromen-2-one (1/1) from Mesua elegans
title_sort 6-[(2e)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(2-methyl­butano­yl)-4-phenyl-2h-chromen-2-one–6-[(2e)-3,7-dimethyl­octa-2,6-dien-1-yl]-5,7-dihy­droxy-8-(3-methyl­butano­yl)-4-phenyl-2h-chromen-2-one (1/1) from mesua elegans
publisher International Union of Crystallography
publishDate 2012
url http://eprints.um.edu.my/10495/1/6.pdf
http://eprints.um.edu.my/10495/
_version_ 1643688814103756800
score 13.188404