Crystallography Open Database

Information card for entry 7702627

Preview

Coordinates	7702627.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H48 N10 O17 Zn2
Calculated formula	C41 H32 N10 O17 Zn2
Title of publication	Complex-formation reactions of Cu(ii) and Zn(ii) 2,2′-bipyridine and 1,10-phenanthroline complexes with bicarbonate. Identification of different carbonate coordination modes
Authors of publication	Mao, Zong-Wan; Heinemann, Frank W.; Liehr, Günther; Eldik, Rudi van
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2001
Journal issue	24
Pages of publication	3652
a	10.976 ± 0.002 Å
b	14.009 ± 0.002 Å
c	16.347 ± 0.003 Å
α	90°
β	107.84 ± 0.01°
γ	90°
Cell volume	2392.7 ± 0.7 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.1178
Residual factor for significantly intense reflections	0.0606
Weighted residual factors for all reflections	0.1508
Weighted residual factors for significantly intense reflections	0.122
Goodness-of-fit parameter for all reflections	1.052
Goodness-of-fit parameter for significantly intense reflections	1.135
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
243928 (current)	2019-11-28	cif/ Adding structures of 7702623, 7702624, 7702625, 7702626, 7702627 via cif-deposit CGI script.	7702627.cif