Crystallography Open Database

Information card for entry 4102050

4102049 << 4102050 >> 4102051

Preview

Coordinates	4102050.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H31 N2 O P
Calculated formula	C39 H30 N2 O P
Title of publication	Catalytic Carbon-Carbon Bond-Forming Reactions of Aminoalkane Derivatives with Imines
Authors of publication	Yi-Jing Chen; Kazutaka Seki; Yasuhiro Yamashita; Shū Kobayashi
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	3244 - 3245
a	11.1675 ± 0.001 Å
b	12.1446 ± 0.0011 Å
c	13.048 ± 0.001 Å
α	105.494 ± 0.002°
β	104.912 ± 0.002°
γ	108.973 ± 0.002°
Cell volume	1493.2 ± 0.2 Å³
Cell temperature	93.1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0533
Weighted residual factors for all reflections included in the refinement	0.0558
Goodness-of-fit parameter for all reflections included in the refinement	4.785
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4102050.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4102050.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4102050.cif
24872	2011-09-08	../uploads/cif-deposit/cod/cif Adding structures of 4102050 via cif-deposit CGI script.	4102050.cif