Crystallography Open Database

Information card for entry 7019934

7019933 << 7019934 >> 7019935

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Coordinates	7019934.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H42 Fe
Calculated formula	C30 H42 Fe
Title of publication	Axial chiral metallocenes by two-fold ring-closing metathesis.
Authors of publication	Buchowicz, W.; Furmańczyk, A; Zachara, J.; Majchrzak, M.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	31
Pages of publication	9269 - 9271
a	9.8085 ± 0.0002 Å
b	10.922 ± 0.0002 Å
c	13.2038 ± 0.0003 Å
α	67.299 ± 0.0019°
β	85.9538 ± 0.0017°
γ	75.7027 ± 0.0018°
Cell volume	1264.02 ± 0.05 Å³
Cell temperature	100.15 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0477
Residual factor for significantly intense reflections	0.0379
Weighted residual factors for significantly intense reflections	0.0905
Weighted residual factors for all reflections included in the refinement	0.0957
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179903 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/99.	7019934.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7019934.cif
64362	2012-08-12	cif/ Adding structures of 7019932, 7019933, 7019934 via cif-deposit CGI script.	7019934.cif