Crystallography Open Database

Information card for entry 7702883

Preview

Coordinates	7702883.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H25 Cl2 Fe N9 O2
Calculated formula	C21 H25 Cl2 Fe N9 O2
Title of publication	Pyrazolyl methyls prescribe the electronic properties of iron(II) tetra(pyrazolyl)lutidine chloride complexes.
Authors of publication	Morin, Tyler J.; Wanniarachchi, Sarath; Gwengo, Chengeto; Makura, Vitales; Tatlock, Heidi M.; Lindeman, Sergey V.; Bennett, Brian; Long, Gary J.; Grandjean, Fernande; Gardinier, James R.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	31
Pages of publication	8024 - 8034
a	11.8184 ± 0.0002 Å
b	11.02252 ± 0.00016 Å
c	18.9571 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	2469.51 ± 0.06 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	36
Hermann-Mauguin space group symbol	C m c 21
Hall space group symbol	C 2c -2
Residual factor for all reflections	0.0303
Residual factor for significantly intense reflections	0.0293
Weighted residual factors for significantly intense reflections	0.078
Weighted residual factors for all reflections included in the refinement	0.0783
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
244150 (current)	2019-11-28	cif/ Adding structures of 7702883, 7702884, 7702885, 7702886, 7702887, 7702888, 7702889 via cif-deposit CGI script.	7702883.cif