Crystallography Open Database

Information card for entry 1504737

Preview

Coordinates	1504737.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H9.6 Cl4 O4
Calculated formula	C10 H9.6 Cl4 O4
Title of publication	A chiral pool approach to the synthesis of optically active tetrahalo norbornyl building blocks.
Authors of publication	Khan, Faiz Ahmed; Sudheer, Ch
Journal of publication	Organic letters
Year of publication	2008
Journal volume	10
Journal issue	14
Pages of publication	3029 - 3032
a	29.003 ± 0.003 Å
b	8.7758 ± 0.0007 Å
c	13.4454 ± 0.0011 Å
α	90°
β	94.309 ± 0.003°
γ	90°
Cell volume	3412.5 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0984
Residual factor for significantly intense reflections	0.0682
Weighted residual factors for significantly intense reflections	0.1296
Weighted residual factors for all reflections included in the refinement	0.1762
Goodness-of-fit parameter for all reflections included in the refinement	1.084
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	1504737.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1504737.cif
42328	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 1504736, 1504737 via cif-deposit CGI script.	1504737.cif