Crystallography Open Database

Information card for entry 4115129

Preview

Coordinates	4115129.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H18 N2 O4
Calculated formula	C20 H18 N2 O4
Title of publication	The Topochemical 1,6-Polymerization of a Triene
Authors of publication	Tram Hoang; Joseph W. Lauher; Frank W. Fowler
Journal of publication	Journal of the American Chemical Society
Year of publication	2002
Journal volume	124
Pages of publication	10656 - 10657
a	9.912 ± 0.004 Å
b	7.252 ± 0.002 Å
c	13.582 ± 0.004 Å
α	90°
β	114.32 ± 0.05°
γ	90 ± 1°
Cell volume	889.7 ± 0.6 Å³
Cell temperature	296.2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0712
Residual factor for significantly intense reflections	0.071
Weighted residual factors for all reflections	0.0519
Weighted residual factors for all reflections included in the refinement	0.052
Goodness-of-fit parameter for all reflections	2.401
Goodness-of-fit parameter for all reflections included in the refinement	2.4
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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