Crystallography Open Database

Information card for entry 4511416

Preview

Coordinates	4511416.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H30 O16 P4 Zn3
Calculated formula	C10 H22 O16 P4 Zn3
Title of publication	Isoreticular Investigation into the Formation of Four New Zinc Alkylbisphosphonate Families
Authors of publication	Gagnon, Kevin J.; Teat, Simon J.; Beal, Zachary J.; Embry, Alyssa M.; Strayer, Megan E.; Clearfield, Abraham
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	7
Pages of publication	3612
a	24.408 ± 0.004 Å
b	27.827 ± 0.005 Å
c	5.1509 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	3498.5 ± 1 Å³
Cell temperature	110 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	5
Space group number	59
Hermann-Mauguin space group symbol	P m m n
Hall space group symbol	-P 2ab 2a
Residual factor for all reflections	0.0918
Residual factor for significantly intense reflections	0.0613
Weighted residual factors for significantly intense reflections	0.1504
Weighted residual factors for all reflections included in the refinement	0.1608
Goodness-of-fit parameter for all reflections included in the refinement	1.027
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
179661 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/14.	4511416.cif
119043	2014-07-05	cif/ Updating files of 4511411, 4511412, 4511413, 4511414, 4511415, 4511416, 4511417, 4511418, 4511419, 4511420, 4511421 Original log message: Adding full bibliography for 4511411--4511421.cif.	4511416.cif
117926	2014-06-21	cif/ Adding structures of 4511411, 4511412, 4511413, 4511414, 4511415, 4511416, 4511417, 4511418, 4511419, 4511420, 4511421 via cif-deposit CGI script.	4511416.cif